Results for:
chemical Classification: organosilicon compounds

[dimethyl(trimethylsilyloxy)silyl]oxy-dimethyl-trimethylsilyloxysilane

Mass-Spectra

Compound Details

Synonymous names
DECAMETHYLTETRASILOXANE
141-62-8
1,1,1,3,3,5,5,7,7,7-Decamethyltetrasiloxane
Tetrasiloxane, decamethyl-
decamethyl tetrasiloxane
Tetrasiloxane, 1,1,1,3,3,5,5,7,7,7-decamethyl-
C23WAL597T
MFCD00008263
[dimethyl(trimethylsilyloxy)silyl]oxy-dimethyl-trimethylsilyloxysilane
UNII-C23WAL597T
C10H30O3Si4
[(CH3)3SiOSi(CH3)2]2O
EINECS 205-491-7
decamethyletrasiloxane
EC 205-491-7
SCHEMBL33683
Decamethyltetrasiloxane, 97%
DECAMETHYLTETRASILOXANE?
TETRASILOXANE, DECAMETHYL
DTXSID2044551
YFCGDEUVHLPRCZ-UHFFFAOYSA-
DECAMETHYLTETRASILOXANE [MI]
AC7887
CD3780
AKOS015840181
FS-4552
SY041908
DB-042574
CS-0204019
D2314
D3780
NS00041635
S05500
J-007527
J-520210
Q4004975
1,1,1,3,3,5,5,7,7,7-Decamethyltetrasiloxane #
N-2-NITROPHENYLSULFENYL-L-VALINEDICYCLOHEXYLAMMONIUMSALT
(dimethyl-trimethylsilyloxysilyl)oxy-dimethyl-trimethylsilyloxysilane
2,2,4,4,6,6,8,8-octamethyl-3,5,7-trioxa-2,4,6,8-tetrasilanonane
1,1,1,3,3,5,5,7,7,7-Decamethyltetrasiloxane; SH 200-1.5CS; DC 200 Fluid 1.5; 1,1,3,3-Tetramethyl-1,3-bis(trimethylsiloxy)disiloxane; KF 96L1.5
97.0% pound D4 pound(1/4)0.1% pound notD5 pound(1/4)0.1% pound notD6 pound(1/4)0.1% pound(c)
InChI=1/C10H30O3Si4/c1-14(2,3)11-16(7,8)13-17(9,10)12-15(4,5)6/h1-10H3
Microorganism:

Yes

IUPAC name[dimethyl(trimethylsilyloxy)silyl]oxy-dimethyl-trimethylsilyloxysilane
SMILESC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)C
InchiInChI=1S/C10H30O3Si4/c1-14(2,3)11-16(7,8)13-17(9,10)12-15(4,5)6/h1-10H3
FormulaC10H30O3Si4
PubChem ID8852
Molweight310.68
LogP0
Atoms17
Bonds6
H-bond Acceptor3
H-bond Donor0
Chemical Classificationorganosilicon compounds siloxanes

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaMoraxella Catarrhalishumans, respiratory infectionsAbd El Qader et al. 2015
ProkaryotaHaemophilus Influenzaehumans, respiratory infectionsAbd El Qader et al. 2015
ProkaryotaLegionella Pneumophilahumans, respiratory infectionsAbd El Qader et al. 2015
ProkaryotaMoraxella Catarrhaliscould serve as potential biomarkers to distinguish between viruses and bacteriaNAAbd El Qader et al. 2015
ProkaryotaHaemophilus Influenzaecould serve as potential biomarkers to distinguish between viruses and bacteriaNAAbd El Qader et al. 2015
ProkaryotaLegionella Pneumophilacould serve as potential biomarkers to distinguish between viruses and bacteriaNAAbd El Qader et al. 2015
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaMoraxella Catarrhalisblood culture mediumSPME-GC-MSno
ProkaryotaHaemophilus Influenzaeblood culture mediumSPME-GC-MSno
ProkaryotaLegionella Pneumophilablood culture mediumSPME-GC-MSno
ProkaryotaMoraxella Catarrhalisblood cultureSPME/GC-MS no
ProkaryotaHaemophilus Influenzaeblood cultureSPME/GC-MS no
ProkaryotaLegionella Pneumophilablood cultureSPME/GC-MS no


Trimethylsilyl 2-bis(trimethylsilyloxy)phosphorylacetate

Compound Details

Synonymous names
53044-27-2
BHJOIVXJMQHKIY-UHFFFAOYSA-N
Acetic acid, [bis[(trimethylsilyl)oxy]phosphinyl]-, trimethylsilyl ester
Phosphonoacetic Acid, 3TMS derivative
DB-310756
Trimethylsilyl (bis[(trimethylsilyl)oxy]phosphoryl)acetate #
[Bis[(trimethylsilyl)oxy]phosphinyl ]acetic acid trimethylsilyl ester
Microorganism:

Yes

IUPAC nametrimethylsilyl 2-bis(trimethylsilyloxy)phosphorylacetate
SMILESC[Si](C)(C)OC(=O)CP(=O)(O[Si](C)(C)C)O[Si](C)(C)C
InchiInChI=1S/C11H29O5PSi3/c1-18(2,3)14-11(12)10-17(13,15-19(4,5)6)16-20(7,8)9/h10H2,1-9H3
FormulaC11H29O5PSi3
PubChem ID631032
Molweight356.57
LogP0
Atoms20
Bonds8
H-bond Acceptor5
H-bond Donor0
Chemical Classificationorganosilicon compounds esters phosphorus compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaRahnella Aquatilisisolate from the rhizosphere soil of a 28-year-old Pinus massoniana in Nanning, Guangxi; stored in the typical Culture Preservation Center of ChinaKong et al. 2020
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaRahnella AquatilisLB mediaHS-SPME/GC-MSyes


4-methyl-4-(4-trimethylsilyloxyphenyl)pentan-2-one

Compound Details

Synonymous names
4-(4-Hydroxyphenyl)-4-methyl-2-pentanone, TMS derivative
Trimethyl[4-(2-methyl-4-oxo-2-pentyl)phenoxy]silane
OZWRGFMVGUCVJF-UHFFFAOYSA-N
4-Methyl-4-(4-[(trimethylsilyl)oxy]phenyl)-2-pentanone #
Microorganism:

Yes

IUPAC name4-methyl-4-(4-trimethylsilyloxyphenyl)pentan-2-one
SMILESCC(=O)CC(C)(C)C1=CC=C(C=C1)O[Si](C)(C)C
InchiInChI=1S/C15H24O2Si/c1-12(16)11-15(2,3)13-7-9-14(10-8-13)17-18(4,5)6/h7-10H,11H2,1-6H3
FormulaC15H24O2Si
PubChem ID610039
Molweight264.43
LogP0
Atoms18
Bonds5
H-bond Acceptor2
H-bond Donor0
Chemical Classificationbenzenoids organosilicon compounds aromatic compounds aromatic ketones ketones

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


1-(4-trimethylsilyloxyphenyl)propan-1-one

Compound Details

Synonymous names
Paroxypropione, TMS derivative
Propiophenone, 4'-(trimethylsiloxy)-
33342-89-1
1-(4-trimethylsilyloxyphenyl)propan-1-one
1-Propanone, 1-[4-[(trimethylsilyl)oxy]phenyl]-
DTXSID40345664
LKRFHGYECXRRCO-UHFFFAOYSA-N
Trimethylsilyl ether of p-hydroxypropiophenone
1-(4-[(Trimethylsilyl)oxy]phenyl)-1-propanone #
Microorganism:

Yes

IUPAC name1-(4-trimethylsilyloxyphenyl)propan-1-one
SMILESCCC(=O)C1=CC=C(C=C1)O[Si](C)(C)C
InchiInChI=1S/C12H18O2Si/c1-5-12(13)10-6-8-11(9-7-10)14-15(2,3)4/h6-9H,5H2,1-4H3
FormulaC12H18O2Si
PubChem ID606216
Molweight222.35
LogP0
Atoms15
Bonds4
H-bond Acceptor2
H-bond Donor0
Chemical Classificationbenzenoids organosilicon compounds aromatic compounds aromatic ketones ketones

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


Tert-butyl-(2-methoxyethoxy)-dimethylsilane

Compound Details

Synonymous names
SCHEMBL3024380
2-Methoxyethanol, TBDMS derivative
(2-methoxyethoxy)-t-butyldimethylsilane
t-butyl dimethyl 2-methoxyethoxy silane
(2-methoxyethoxy)-tert-butyldimethylsilane
tert-Butyl-(2-methoxyethoxy)dimethylsilane
2,2,3,3-Tetramethyl-4,7-dioxa-3-silaoctane
Microorganism:

Yes

IUPAC nametert-butyl-(2-methoxyethoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCOC
InchiInChI=1S/C9H22O2Si/c1-9(2,3)12(5,6)11-8-7-10-4/h7-8H2,1-6H3
FormulaC9H22O2Si
PubChem ID11805534
Molweight190.35
LogP0
Atoms12
Bonds5
H-bond Acceptor2
H-bond Donor0
Chemical Classificationorganosilicon compounds ethers

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno


[dimethyl(propan-2-yl)silyl] Octadecanoate

Compound Details

Synonymous names
Octadecanoic acid, dimethyl(isopropyl)silyl ester
TWNUYJNPVQXNQN-UHFFFAOYSA-N
Isopropyl(dimethyl)silyl stearate #
Microorganism:

Yes

IUPAC name[dimethyl(propan-2-yl)silyl] octadecanoate
SMILESCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C(C)C
InchiInChI=1S/C23H48O2Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(24)25-26(4,5)22(2)3/h22H,6-21H2,1-5H3
FormulaC23H48O2Si
PubChem ID631036
Molweight384.7
LogP0
Atoms26
Bonds19
H-bond Acceptor2
H-bond Donor0
Chemical Classificationorganosilicon compounds esters

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStenotrophomonas Maltophiliaantifungal activity against Colletotrichum nymphaeaeisolated from the healthy strawberry leaf in Kamyaran, Kurdistan provinceAlijani et al. 2020
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStenotrophomonas MaltophiliaNA mediaGC-MSno


Tripropylsilyl Tridecanoate

Compound Details

Synonymous names
Tridecanoic acid, tripropylsilyl ester
Tripropylsilyl tridecanoate #
IKFJXWWULCMCQD-UHFFFAOYSA-N
Microorganism:

Yes

IUPAC nametripropylsilyl tridecanoate
SMILESCCCCCCCCCCCCC(=O)O[Si](CCC)(CCC)CCC
InchiInChI=1S/C22H46O2Si/c1-5-9-10-11-12-13-14-15-16-17-18-22(23)24-25(19-6-2,20-7-3)21-8-4/h5-21H2,1-4H3
FormulaC22H46O2Si
PubChem ID629952
Molweight370.7
LogP0
Atoms25
Bonds19
H-bond Acceptor2
H-bond Donor0
Chemical Classificationorganosilicon compounds esters

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStenotrophomonas Maltophiliaantifungal activity against Colletotrichum nymphaeaeisolated from the healthy strawberry leaf in Kamyaran, Kurdistan provinceAlijani et al. 2020
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStenotrophomonas MaltophiliaNA mediaGC-MSno


Trimethylsilyl 2,6-bis(trimethylsilyloxy)benzoate

Compound Details

Synonymous names
2,6-Bis(trimethylsilyloxy)benzoic acid trimethylsilyl ester
Benzoic acid, 2,6-bis[(trimethylsilyl)oxy]-, trimethylsilyl ester
Trimethylsilyl 2,6-bis[(trimethylsilyl)oxy]benzoate
3782-85-2
APVNJYLNHAHELF-UHFFFAOYSA-N
DTXSID301346412
Benzoic acid, 2,6-dihydroxy, tri-TMS
2,6-Dihydroxybenzoic acid, 3TMS derivative
Q63391901
Trimethylsilyl 2,6-bis[(trimethylsilyl)oxy]benzoate #
2,6-Dihydroxybenzoic acid, bis(trimethylsilyl) ether, trimethylsilyl ester
Microorganism:

Yes

IUPAC nametrimethylsilyl 2,6-bis(trimethylsilyloxy)benzoate
SMILESC[Si](C)(C)OC1=C(C(=CC=C1)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InchiInChI=1S/C16H30O4Si3/c1-21(2,3)18-13-11-10-12-14(19-22(4,5)6)15(13)16(17)20-23(7,8)9/h10-12H,1-9H3
FormulaC16H30O4Si3
PubChem ID520869
Molweight370.66
LogP0
Atoms23
Bonds7
H-bond Acceptor4
H-bond Donor0
Chemical Classificationaromatic compounds organosilicon compounds benzenoids

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


Trimethylsilyl 2,3-bis(trimethylsilyloxy)benzoate

Compound Details

Synonymous names
Benzoic acid, 2,3-bis[(trimethylsilyl)oxy]-, trimethylsilyl ester
Trimethylsilyl 2,3-bis[(trimethylsilyl)oxy]benzoate
IPIPJXIWUUYKNS-UHFFFAOYSA-N
Benzoic acid, 2,3-dihydroxy, tri-TMS
2,3-Dihydroxybenzoic acid, 3TMS derivative
Q63408910
Trimethylsilyl 2,3-bis[(trimethylsilyl)oxy]benzoate #
2,3-BIS(TRIMETHYLSILYL)OXY-BENZOIC ACID TRIMETHYLSILYL ESTER
Microorganism:

Yes

IUPAC nametrimethylsilyl 2,3-bis(trimethylsilyloxy)benzoate
SMILESC[Si](C)(C)OC1=CC=CC(=C1O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InchiInChI=1S/C16H30O4Si3/c1-21(2,3)18-14-12-10-11-13(15(14)19-22(4,5)6)16(17)20-23(7,8)9/h10-12H,1-9H3
FormulaC16H30O4Si3
PubChem ID520778
Molweight370.66
LogP0
Atoms23
Bonds7
H-bond Acceptor4
H-bond Donor0
Chemical Classificationaromatic compounds organosilicon compounds benzenoids

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


Trimethyl-(2-trimethylsilylphenyl)silane

Mass-Spectra

Compound Details

Synonymous names
1,2-Bis(trimethylsilyl)benzene
17151-09-6
trimethyl-(2-trimethylsilylphenyl)silane
Trimethyl[2-(trimethylsilyl)phenyl]silane
MFCD00015590
DTXSID30334143
Silane, 1,2-phenylenebis[trimethyl-
AKOS015840092
MCULE-6388806568
1,2-PHENYLENEBIS(TRIMETHYLSILANE)
SY053637
B2299
CS-0336873
Trimethyl[2-(trimethylsilyl)phenyl]silane #
T70415
Microorganism:

Yes

IUPAC nametrimethyl-(2-trimethylsilylphenyl)silane
SMILESC[Si](C)(C)C1=CC=CC=C1[Si](C)(C)C
InchiInChI=1S/C12H22Si2/c1-13(2,3)11-9-7-8-10-12(11)14(4,5)6/h7-10H,1-6H3
FormulaC12H22Si2
PubChem ID519794
Molweight222.47
LogP0
Atoms14
Bonds2
H-bond Acceptor0
H-bond Donor0
Chemical Classificationaromatic compounds organosilicon compounds benzenoids

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaMoraxella Catarrhaliscould serve as potential biomarkers to distinguish between viruses and bacteriaNAAbd El Qader et al. 2015
ProkaryotaHaemophilus Influenzaecould serve as potential biomarkers to distinguish between viruses and bacteriaNAAbd El Qader et al. 2015
ProkaryotaLegionella Pneumophilacould serve as potential biomarkers to distinguish between viruses and bacteriaNAAbd El Qader et al. 2015
ProkaryotaMoraxella Catarrhalishumans, respiratory infectionsAbd El Qader et al. 2015
ProkaryotaHaemophilus Influenzaehumans, respiratory infectionsAbd El Qader et al. 2015
ProkaryotaLegionella Pneumophilahumans, respiratory infectionsAbd El Qader et al. 2015
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaMoraxella Catarrhalisblood cultureSPME/GC-MS no
ProkaryotaHaemophilus Influenzaeblood cultureSPME/GC-MS no
ProkaryotaLegionella Pneumophilablood cultureSPME/GC-MS no
ProkaryotaMoraxella Catarrhalisblood culture mediumSPME-GC-MSno
ProkaryotaHaemophilus Influenzaeblood culture mediumSPME-GC-MSno
ProkaryotaLegionella Pneumophilablood culture mediumSPME-GC-MSno


Trimethylsilyl 3-methyl-2-trimethylsilyloxybenzoate

Compound Details

Synonymous names
MMUCIJOPDDWEJV-UHFFFAOYSA-N
Benzoic acid, 3-methyl-2-trimethylsilyloxy-, trimethylsilyl ester
3-Methylsalicylic acid, 2TMS derivative
Q63409705
Trimethylsilyl 3-methyl-2-[(trimethylsilyl)oxy]benzoate #
3-METHYL-2-(TRIMETHYLSILYL)OXYBENZOIC ACIDTRIMETHYLSILYL ESTER
Microorganism:

Yes

IUPAC nametrimethylsilyl 3-methyl-2-trimethylsilyloxybenzoate
SMILESCC1=C(C(=CC=C1)C(=O)O[Si](C)(C)C)O[Si](C)(C)C
InchiInChI=1S/C14H24O3Si2/c1-11-9-8-10-12(13(11)16-18(2,3)4)14(15)17-19(5,6)7/h8-10H,1-7H3
FormulaC14H24O3Si2
PubChem ID624536
Molweight296.51
LogP0
Atoms19
Bonds5
H-bond Acceptor3
H-bond Donor0
Chemical Classificationaromatic compounds organosilicon compounds esters benzenoids

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


3-methoxy-2-trimethylsilyloxybenzaldehyde

Compound Details

Synonymous names
o-Vanillin, TMS derivative
NVFQNBMOSVRDKT-UHFFFAOYSA-N
3-methoxy-2-[(trimethylsilyl)oxy]benzaldehyde
EN300-45209690
2-Hydroxy-3-methoxybenzaldehyde, trimethylsilyl ether
Microorganism:

Yes

IUPAC name3-methoxy-2-trimethylsilyloxybenzaldehyde
SMILESCOC1=CC=CC(=C1O[Si](C)(C)C)C=O
InchiInChI=1S/C11H16O3Si/c1-13-10-7-5-6-9(8-12)11(10)14-15(2,3)4/h5-8H,1-4H3
FormulaC11H16O3Si
PubChem ID91734149
Molweight224.33
LogP0
Atoms15
Bonds4
H-bond Acceptor3
H-bond Donor0
Chemical Classificationaromatic compounds aromatic aldehydes organosilicon compounds aldehydes benzaldehydes benzenoids

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


2-[3,4-bis(trimethylsilyloxy)phenyl]-N,N-dimethyl-2-trimethylsilyloxyethanamine

Compound Details

Synonymous names
N-Methyladrenaline, tri-TMS
UVFBJUNBLLVBTA-UHFFFAOYSA-N
N-Methyladrenaline, 3TMS derivative
2-(3,4-Bis[(trimethylsilyl)oxy]phenyl)-N,N-dimethyl-2-[(trimethylsilyl)oxy]ethanamine #
Microorganism:

Yes

IUPAC name2-[3,4-bis(trimethylsilyloxy)phenyl]-N,N-dimethyl-2-trimethylsilyloxyethanamine
SMILESCN(C)CC(C1=CC(=C(C=C1)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
InchiInChI=1S/C19H39NO3Si3/c1-20(2)15-19(23-26(9,10)11)16-12-13-17(21-24(3,4)5)18(14-16)22-25(6,7)8/h12-14,19H,15H2,1-11H3
FormulaC19H39NO3Si3
PubChem ID552250
Molweight413.8
LogP0
Atoms26
Bonds9
H-bond Acceptor4
H-bond Donor0
Chemical Classificationaromatic compounds organosilicon compounds nitrogen compounds amines benzenoids

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


5-methyl-N-trimethylsilyl-1,2-oxazol-3-amine

Compound Details

Synonymous names
5-Methyl-N-(trimethylsilyl)isoxazol-3-amine
99356-57-7
PRHAHKRWNHLXGA-UHFFFAOYSA-N
3-Amino-5-methylisoxazole, N-trimethylsilyl-
3-Isoxazolamine, 5-methyl-N-(trimethylsilyl)-
Microorganism:

Yes

IUPAC name5-methyl-N-trimethylsilyl-1,2-oxazol-3-amine
SMILESCC1=CC(=NO1)N[Si](C)(C)C
InchiInChI=1S/C7H14N2OSi/c1-6-5-7(8-10-6)9-11(2,3)4/h5H,1-4H3,(H,8,9)
FormulaC7H14N2OSi
PubChem ID13545122
Molweight170.28
LogP0
Atoms11
Bonds2
H-bond Acceptor3
H-bond Donor1
Chemical Classificationorganosilicon compounds heterocyclic compounds nitrogen compounds aromatic compounds azoles

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


Methyl 2-[(4-trimethylsilyloxybenzoyl)amino]acetate

Compound Details

Synonymous names
XQZAMQVFBIDPPF-UHFFFAOYSA-N
Glycine, N-[4-[(trimethylsilyl)oxy]benzoyl]-, methyl ester
55638-48-7
DB-326952
Methyl ((4-[(trimethylsilyl)oxy]benzoyl)amino)acetate #
N-[4-(TRIMETHYLSILOXY)BENZOYL ]GLYCINE METHYL ESTER
Microorganism:

Yes

IUPAC namemethyl 2-[(4-trimethylsilyloxybenzoyl)amino]acetate
SMILESCOC(=O)CNC(=O)C1=CC=C(C=C1)O[Si](C)(C)C
InchiInChI=1S/C13H19NO4Si/c1-17-12(15)9-14-13(16)10-5-7-11(8-6-10)18-19(2,3)4/h5-8H,9H2,1-4H3,(H,14,16)
FormulaC13H19NO4Si
PubChem ID606217
Molweight281.38
LogP0
Atoms19
Bonds6
H-bond Acceptor4
H-bond Donor1
Chemical Classificationbenzenoids aromatic compounds organosilicon compounds esters amides nitrogen compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


2-[tris[(2-methylpropan-2-yl)oxy]silylsulfanyl]ethanamine

Compound Details

Synonymous names
S-[Tri-t-butoxysilyl]-2-mercaptoethylamine
DGCZHBIIRHUZRT-UHFFFAOYSA-N
2-([Tri(tert-butoxy)silyl]sulfanyl)ethylamine #
Microorganism:

Yes

IUPAC name2-[tris[(2-methylpropan-2-yl)oxy]silylsulfanyl]ethanamine
SMILESCC(C)(C)O[Si](OC(C)(C)C)(OC(C)(C)C)SCCN
InchiInChI=1S/C14H33NO3SSi/c1-12(2,3)16-20(19-11-10-15,17-13(4,5)6)18-14(7,8)9/h10-11,15H2,1-9H3
FormulaC14H33NO3SSi
PubChem ID541775
Molweight323.57
LogP0
Atoms20
Bonds9
H-bond Acceptor5
H-bond Donor1
Chemical Classificationamines sulfur compounds organosilicon compounds nitrogen compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaMoraxella Catarrhalishumans, respiratory infectionsAbd El Qader et al. 2015
ProkaryotaLegionella Pneumophilahumans, respiratory infectionsAbd El Qader et al. 2015
ProkaryotaHaemophilus Influenzaecould serve as potential biomarkers to distinguish between viruses and bacteriaNAAbd El Qader et al. 2015
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaMoraxella Catarrhalisblood culture mediumSPME-GC-MSno
ProkaryotaLegionella Pneumophilablood culture mediumSPME-GC-MSno
ProkaryotaHaemophilus Influenzaeblood cultureSPME/GC-MS no


Diethyl-heptan-2-yloxy-tetradecoxysilane

Compound Details

Synonymous names
CXVHMMIMOMXHIK-UHFFFAOYSA-N
Silane, diethyl(2-heptyloxy)tetradecyloxy-
Microorganism:

Yes

IUPAC namediethyl-heptan-2-yloxy-tetradecoxysilane
SMILESCCCCCCCCCCCCCCO[Si](CC)(CC)OC(C)CCCCC
InchiInChI=1S/C25H54O2Si/c1-6-10-12-13-14-15-16-17-18-19-20-22-24-26-28(8-3,9-4)27-25(5)23-21-11-7-2/h25H,6-24H2,1-5H3
FormulaC25H54O2Si
PubChem ID91744464
Molweight414.8
LogP0
Atoms28
Bonds22
H-bond Acceptor2
H-bond Donor0
Chemical Classificationorganosilicon compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno


2,2,4,4,6,6,8,8,10,10,12,12,14,14-tetradecamethyl-1,3,5,7,9,11,13-heptaoxa-2,4,6,8,10,12,14-heptasilacyclotetradecane

Compound Details

Synonymous names
TETRADECAMETHYLCYCLOHEPTASILOXANE
107-50-6
Cyclomethicone 7
Cycloheptasiloxane, tetradecamethyl-
2,2,4,4,6,6,8,8,10,10,12,12,14,14-tetradecamethyl-1,3,5,7,9,11,13-heptaoxa-2,4,6,8,10,12,14-heptasilacyclotetradecane
tetradecamethyl cycloheptasiloxane
KCK5L8VU47
UNII-KCK5L8VU47
EINECS 203-496-9
Cycloheptasiloxane,2,2,4,4,6,6,8,8,10,10,12,12,14,14-tetradecamethyl-
Tetradecamethylcyclotetradecaneheptasiloxane
SCHEMBL375229
DTXSID8059348
CHEBI:87988
CYCLOHEPTASILOXANE [INCI]
MFCD30534308
AKOS028110683
J182.220I
NS00041292
T2678
T71579
Q27160005
2,2,4,4,6,6,8,8,10,10,12,12,14,14-Tetradecamethylcycloheptasiloxane
2,2,4,4,6,6,8,8,10,10,12,12,14,14-Tetradecamethylcycloheptasiloxane #
2,2,4,4,6,6,8,8,10,10,12,12,14,14-TETRADECAMETHYLCYCLOTETRADECANEHEPTASILOXANE
CYCLOHEPTASILOXANE, 2,2,4,4,6,6,8,8,10,10,12,12,14,14-TETRADECAMETHYL-
D-7
D7
Microorganism:

Yes

IUPAC name2,2,4,4,6,6,8,8,10,10,12,12,14,14-tetradecamethyl-1,3,5,7,9,11,13-heptaoxa-2,4,6,8,10,12,14-heptasilacyclotetradecane
SMILESC[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)(C)C)C
InchiInChI=1S/C14H42O7Si7/c1-22(2)15-23(3,4)17-25(7,8)19-27(11,12)21-28(13,14)20-26(9,10)18-24(5,6)16-22/h1-14H3
FormulaC14H42O7Si7
PubChem ID7874
Molweight519.07
LogP0
Atoms28
Bonds0
H-bond Acceptor7
H-bond Donor0
Chemical Classificationorganosilicon compounds
CHEBI-ID87988
Supernatural-IDSN0113817

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStenotrophomonas Maltophiliaantifungal activity against Colletotrichum nymphaeaeisolated from the healthy strawberry leaf in Kamyaran, Kurdistan provinceAlijani et al. 2020
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStenotrophomonas MaltophiliaNA mediaGC-MSno


2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexasilacyclododecane

Compound Details

Synonymous names
DODECAMETHYLCYCLOHEXASILOXANE
540-97-6
Cyclohexasiloxane, dodecamethyl-
Cyclomethicone 6
2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexasilacyclododecane
XHK3U310BA
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane
EINECS 208-762-8
UNII-XHK3U310BA
HSDB 7723
EC 208-762-8
dodecamethyl cyclohexasiloxane
SCHEMBL93785
XIAMETER PMX-0246
CYCLOHEXASILOXANE [INCI]
DTXSID6027183
IUMSDRXLFWAGNT-UHFFFAOYSA-
CHEBI:191103
CYCLOMETHICONE 6 [USP-RS]
MFCD00144215
CYCLOHEXASILOXANE, DODECAMETHYL
AKOS015839990
FS-5671
DODECAMETHYLCYCLOHEXASILOXANE [MI]
DODECAMETHYLCYCLOHEXASILOXANE [HSDB]
DB-008587
D2040
DODECAMETHYLCYCLOHEXASILOXANE [WHO-DD]
NS00042693
S08515
T71035
Dodecamethylcyclohexasiloxane, analytical standard
A914553
Q27293843
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane #
Cyclohexasiloxane, 2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane, 95%
2,2,4,4,6,6,8,8,10,10,12,12-Dodecamethylcyclohexasiloxane, AldrichCPR
Cyclomethicone 6, United States Pharmacopeia (USP) Reference Standard
2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexa
D-6
InChI=1/C12H36O6Si6/c1-19(2)13-20(3,4)15-22(7,8)17-24(11,12)18-23(9,10)16-21(5,6)14-19/h1-12H3
Microorganism:

Yes

IUPAC name2,2,4,4,6,6,8,8,10,10,12,12-dodecamethyl-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexasilacyclododecane
SMILESC[Si]1(O[Si](O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)(C)C)C
InchiInChI=1S/C12H36O6Si6/c1-19(2)13-20(3,4)15-22(7,8)17-24(11,12)18-23(9,10)16-21(5,6)14-19/h1-12H3
FormulaC12H36O6Si6
PubChem ID10911
Molweight444.92
LogP0
Atoms24
Bonds0
H-bond Acceptor6
H-bond Donor0
Chemical Classificationorganosilicon compounds
CHEBI-ID191103
Supernatural-IDSN0155663

mVOC Specific Details

Boiling Point
DegreeReference
245 °C peer reviewed
Volatilization
The Henry's Law constant for dodecamethylcyclohexasiloxane is 25.0 atm-cu m/mole(1). This Henry's Law constant indicates that dodecamethylcyclohexasiloxane is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 6.2 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 8.4 days(SRC). However, volatilization from water surfaces is expected to be attenuated by adsorption to suspended solids and sediment in the water column. The estimated volatilization half-life from a model pond is >1 year if adsorption is considered(3). The Henry's Law constant for dodecamethylcyclohexasiloxane indicates that volatilization from moist soil surfaces is expected(SRC). Dodecamethylcyclohexasiloxane is a volatile methylsiloxane that favors partitioning into the atmosphere(4); therefore, dodecamethylcyclohexasiloxane is expected to volatilize from dry soil surfaces(SRC) even with a vapor pressure of 0.0169 mm Hg(5). Evaporation of dodecamethylcyclohexasiloxane was measured in soil studies and found to occur with rates varying with moisture content, soil type and relative humidity(6). Volatilization from soil may be the major loss process under certain moist conditions(7).
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of dodecamethylcyclohexasiloxane can be estimated to be 870,000(SRC). According to a classification scheme(2), this estimated Koc value suggests that dodecamethylcyclohexasiloxane is expected to be immobile in soil.

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStenotrophomonas Maltophiliaantifungal activity against Colletotrichum nymphaeaeisolated from the healthy strawberry leaf in Kamyaran, Kurdistan provinceAlijani et al. 2020
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
EukaryotaPhytophthora CinnamomiN/APhytophthora cinnamomiQiu R et al. 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStenotrophomonas MaltophiliaNA mediaGC-MSno
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno
EukaryotaPhytophthora CinnamomiPotato Dextrose AgarSPME/GC-MS/MSno


2,2,4,4,6,6,8,8,10,10-decamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane

Compound Details

Synonymous names
DECAMETHYLCYCLOPENTASILOXANE
541-02-6
Cyclopentasiloxane, decamethyl-
Cyclomethicone 5
2,2,4,4,6,6,8,8,10,10-Decamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
CYCLOPENTASILOXANE
Dimethylsiloxane pentamer
Dekamethylcyklopentasiloxan
Dow corning 345
NUC silicone VS 7158
Silicon SF 1202
Ciclopentasiloxane
Cyclic dimethylsiloxane pentamer
Cyclomethicone D5
D5-sil
KF 995
CCRIS 1328
VS 7158
HSDB 5683
UNII-0THT5PCI0R
0THT5PCI0R
Ddecamethylcyclopentasiloxane
EINECS 208-764-9
SF 1202
BRN 1800166
DTXSID1027184
JEESILC CPS-211
XIAMETER PMX-0245
DTXCID907184
CYCLOPENTASILOXANE (D5)
D5
EC 208-764-9
4-04-00-04128 (Beilstein Handbook Reference)
KF-995
DOW CORNING ST CYCLOMETHICONE 5
OCTAMETHYLCYCLOTETRASILOXANE (D5)
KP-545 COMPONENT CYCLOMETHICONE 5
2,2,4,4,6,6,8,8,10,10-decamethyl-1,3,5,7,9,2,4,6,8,10-pentoxapentasilecane
Cyclopentasiloxane, 2,2,4,4,6,6,8,8,10,10-decamethyl-
CYCLOMETHICONE 5 (USP-RS)
CYCLOMETHICONE 5 [USP-RS]
MFCD00046966
Dekamethylcyklopentasiloxan [Czech]
decamethyl cyclopentasiloxane
C10H30O5Si5
Lightening Serum
D5 Cyclomethicone
dimethylcyclopentasiloxane
Decamethylcylopentasiloxane
UNII: 0THT5PCI0R
SCHEMBL28497
N-Propylheptamethyltrisiloxane
CHEMBL1885178
CYCLOPENTASILOXANE [INCI]
3CE PINK IM GOOD MASCARA
CHEBI:191092
Decamethylcyclopentasiloxane, 97%
CYCLOMETHICONE 5 [WHO-DD]
BCP15826
Tox21_303170
CD3770
CYCLOPENTASILOXANE, DECAMETHYL
AKOS008901199
CS-W009767
DB11244
HY-W009051
MCULE-6274880347
DECAMETHYLCYCLOPENTASILOXANE [MI]
NCGC00163981-01
NCGC00257224-01
AS-59731
CAS-541-02-6
DECAMETHYLCYCLOPENTASILOXANE [HSDB]
D1890
D3770
Decamethylcyclopentasiloxane (cyclic monomer)
NS00043162
D78203
S05475
Decamethylcyclopentasiloxane, analytical standard
Q414350
decamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
Cyclomethicone 5, United States Pharmacopeia (USP) Reference Standard
2,2,4,4,6,6,8,8,10,10-Decamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane #
D5 Cyclomethicone, Pharmaceutical Secondary Standard; Certified Reference Material
Microorganism:

Yes

IUPAC name2,2,4,4,6,6,8,8,10,10-decamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
SMILESC[Si]1(O[Si](O[Si](O[Si](O[Si](O1)(C)C)(C)C)(C)C)(C)C)C
InchiInChI=1S/C10H30O5Si5/c1-16(2)11-17(3,4)13-19(7,8)15-20(9,10)14-18(5,6)12-16/h1-10H3
FormulaC10H30O5Si5
PubChem ID10913
Molweight370.77
LogP0
Atoms20
Bonds0
H-bond Acceptor5
H-bond Donor0
Chemical Classificationorganosilicon compounds
CHEBI-ID191092
Supernatural-IDSN0434476

mVOC Specific Details

Boiling Point
DegreeReference
210 °C peer reviewed
Volatilization
The Henry's Law constant for decamethylcyclopentasiloxane is 33.0 atm-cu m/mole(1). This Henry's Law constant indicates that decamethylcyclopentasiloxane is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 5.6 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 7.6 days(SRC). However, volatilization from water surfaces is expected to be attenuated by adsorption to suspended solids and sediment in the water column. The estimated volatilization half-life from a model pond is 3.8 years if adsorption is considered(3). Decamethylcyclopentasiloxane's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). However, adsorption to soil is expected to attenuate volatilization(SRC). Decamethylcyclopentasiloxane is a volatile methylsiloxane that favors partitioning into the atmosphere(4); therefore, decamethylcyclopentasiloxane is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 0.3 mm Hg(5). Evaporation of decamethylcyclopentasiloxane was measured in soil studies and found to occur with rates varying with moisture content, soil type and relative humidity(6). 14C-labeled decamethylcyclopentasiloxane was removed from municipal waste by both adsorption to sludge and volatilization(7); the majority of the material was removed via volatilization; after 3 days, 40% of the material in the aeration/secondary clarifier was removed by volatilization(7). From its use in cosmetic products, decamethylcyclopentasiloxane is reported to evaporate from skin or hair within 4-12 hours after application(8).
Soil Adsorption
Adsorption studies using three soils from the United Kingdom (silt loam, sandy loam and sandy clay loam) determined decamethylcyclopentasiloxane log Koc values of 4.98-5.29 with an average log Koc of 5.17 (Koc of 1.48X10+5)(1). According to a classification scheme(2), these Koc values suggest that decamethylcyclopentasiloxane is expected to be immobile in soil.

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStenotrophomonas Maltophiliaantifungal activity against Colletotrichum nymphaeaeisolated from the healthy strawberry leaf in Kamyaran, Kurdistan provinceAlijani et al. 2020
EukaryotaZygosaccharomyces RouxiiNANAPei et al. 2022
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStenotrophomonas MaltophiliaNA mediaGC-MSno
EukaryotaZygosaccharomyces RouxiiYPD mediumGC-MSno