Results for:
PubChem ID: 26058

2,2,4,6,6-pentamethylheptane

Compound Details

Synonymous names
2,2,4,6,6-PENTAMETHYLHEPTANE
13475-82-6
Heptane, 2,2,4,6,6-pentamethyl-
A8289P68Y2
2,2,4,6,6-Pentamethylheptane 100 microg/mL in Acetonitrile
UNII-A8289P68Y2
2,2,4,6,6-pentamethyl-heptane
Permethyl 99A
PMH cpd
EINECS 236-757-0
C12 ISOPARAFFIN
ISODODECANE [INCI]
EC 236-757-0
DTXSID0042034
CHEBI:77509
VKPSKYDESGTTFR-UHFFFAOYSA-
MFCD00026334
AKOS024256485
LS-14162
NS00003896
P0047
GRANRESIN MQI-T50 COMPONENT ISODODECANE
J-018544
Q27147086
InChI=1/C12H26/c1-10(8-11(2,3)4)9-12(5,6)7/h10H,8-9H2,1-7H3
Microorganism:

Yes

IUPAC name2,2,4,6,6-pentamethylheptane
SMILESCC(CC(C)(C)C)CC(C)(C)C
InchiInChI=1S/C12H26/c1-10(8-11(2,3)4)9-12(5,6)7/h10H,8-9H2,1-7H3
FormulaC12H26
PubChem ID26058
Molweight170.33
LogP5.6
Atoms12
Bonds4
H-bond Acceptor0
H-bond Donor0
Chemical Classificationaliphatics saturated
CHEBI-ID77509
Supernatural-IDSN0392838

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaEscherichia ColiNANAHewett et al. 2020
ProkaryotaMycobacterium TuberculosisNANAPhillips et al. 2007
EukaryotaAspergillus FlavusITEM collection of CNR-ISPA (Research National Council of Italy - Institute of Sciences of Food Production) in Bari, ItalyJosselin et al. 2021
Lactobacillus PlantarumZhang et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaEscherichia ColiLBSPME/GC-MSno
ProkaryotaMycobacterium TuberculosisVersaTREKTD/GC-MSno
EukaryotaAspergillus FlavusSNA mediaSPME/GC-MSno
Lactobacillus PlantarumHabanero pepperGC–IMSno