Results for:
PubChem ID: 13895

1,4-ditert-butylbenzene

Compound Details

Synonymous names
1,4-Di-tert-butylbenzene
1012-72-2
p-Di-tert-butylbenzene
1,4-ditert-butylbenzene
Benzene, 1,4-bis(1,1-dimethylethyl)-
Benzene, p-di-tert-butyl-
Bis(1,1-dimethylethyl)benzene
55PTX4KH71
NSC-6342
MFCD00008836
Benzene, bis(1,1-dimethylethyl)-
NSC 6342
EINECS 213-790-9
UNII-55PTX4KH71
AI3-11248
NSC6342
1,4-di-t-butylbenzene
1,4-tert-dibutylbenzene
1,4-di-tert.butyl-benzene
1,4-Di-tert-butyl-benzene
CHEMBL1795573
DTXSID4061410
DI-TERT-BUTYLBENZENE, P-
1,4-Di-tert-butylbenzene, 98%
Benzene,4-bis(1,1-dimethylethyl)-
AKOS004907087
MCULE-6142203619
1,4-Bis-(1,1-dimethylethyl)-benzene
BS-14173
SY011163
CS-0128337
D2111
NS00023041
EN300-112854
A800363
AE-641/00770037
J-000353
Q27261326
InChI=1/C14H22/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h7-10H,1-6H
Microorganism:

Yes

IUPAC name1,4-ditert-butylbenzene
SMILESCC(C)(C)C1=CC=C(C=C1)C(C)(C)C
InchiInChI=1S/C14H22/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h7-10H,1-6H3
FormulaC14H22
PubChem ID13895
Molweight190.32
LogP5.3
Atoms14
Bonds2
H-bond Acceptor0
H-bond Donor0
Chemical Classificationaromatic compounds benzenoids alkylbenzenes
Supernatural-IDSN0271296

mVOC Specific Details

Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaCandida AlbicansATCC MYA-2876, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida GlabrataATCC 90030, American Type Culture CollectionCosta et al. 2020
EukaryotaCandida TropicalisATCC 750, American Type Culture CollectionCosta et al. 2020
EukaryotaSaccharomyces CerevisiaeNANAHarris et al. 2021
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaCandida AlbicansYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida GlabrataYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaCandida TropicalisYGC mediaHS-SPME/GC-GC-ToFMSno
EukaryotaSaccharomyces Cerevisiaemalt extract brothHS-SPME with GC-MSno