Results for:
PubChem ID: 11903

1-ethyl-2-methylbenzene

Mass-Spectra

Compound Details

Synonymous names
1-Ethyl-2-methylbenzene
2-Ethyltoluene
611-14-3
O-ETHYLTOLUENE
o-Methylethylbenzene
1-Methyl-2-ethylbenzene
Toluene, o-ethyl-
ortho-Ethyltoluene
Benzene, 1-ethyl-2-methyl-
1,2-methylethylbenzene
o-Ethyl methyl benzene
o-Ethylmethylbenzene
Ethyltoluene
25550-14-5
2-Methylethylbenzene
NSC 405731
2-Methyl-1-ethylbenzene
CHEMBL364233
DBX00873SV
DTXSID2050403
CHEBI:34276
NSC-405731
o-Ethyl methylbenzene
Ethyltoluene, o-
2-ethyl-1-methylbenzene
EINECS 210-255-1
1-ethyl-2-methyl-benzene
BRN 1851237
UNII-DBX00873SV
AI3-28773
2-ethyl toluene
2-ethylmethylbenzene
Toluene, 2-ethyl-
2-Ethyltoluene, 99%
2-Ethyltoluene 100 microg/mL in Methanol
4-05-00-00999 (Beilstein Handbook Reference)
BIDD:ER0573
WLN: 2R B1
DTXCID5029477
Tox21_303797
BDBM50167949
MFCD00009257
NSC405731
AKOS015842902
AC-6953
CS-W009542
DS-2369
MCULE-7161910991
NCGC00356979-01
CAS-611-14-3
DB-024735
A8492
AM20040851
E0184
NS00002055
J-504600
Q27115961
2-Ethyltoluene, certified reference material, TraceCERT(R)
InChI=1/C9H12/c1-3-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H
Microorganism:

Yes

IUPAC name1-ethyl-2-methylbenzene
SMILESCCC1=CC=CC=C1C
InchiInChI=1S/C9H12/c1-3-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3
FormulaC9H12
PubChem ID11903
Molweight120.19
LogP3.5
Atoms9
Bonds1
H-bond Acceptor0
H-bond Donor0
Chemical Classificationaromatic compounds benzenoids alkylbenzenes
CHEBI-ID34276
Supernatural-IDSN0138694

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaStaphylococcus AureusAmerican Type Culture CollectionJenkins and Bean 2020
ProkaryotaBacillus Subtilispromote biomass production of Arabidopsis thalianarhizosphere of Haloxylon ammodendronHe et al. 2023
EukaryotaFusarium Graminearumn/aNABusko et al. 2014
EukaryotaAspergillus Candiduscompost Fischer et al. 1999
ProkaryotaClostridium Difficileoutbreak 2006 UKRees et al. 2016
ProkaryotaSerratia Sp.NANAEtminani et al. 2022
ProkaryotaEnterobacter Sp.NANAEtminani et al. 2022
ProkaryotaPantoea Sp.NANAEtminani et al. 2022
ProkaryotaPseudomonas Sp.NANAEtminani et al. 2022
ProkaryotaLentilactobacillus BuchneriNANASquara et al. 2022
ProkaryotaLacticaseibacillus ParacaseiNANASquara et al. 2022
MicrobacteriumBallot et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaStaphylococcus AureusTSB mediaHS-SPME/GC×GC-TOFMSno
ProkaryotaBacillus Subtilis1/2 MS mediaSPME/GC-MSno
EukaryotaFusarium Graminearumyeast extract sucrose agarSPME/GC-MSno
EukaryotaAspergillus Candidusyest extract sucroseTenax/GC-MSno
ProkaryotaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
ProkaryotaSerratia Sp.nutrient agar (NA)GC–MSno
ProkaryotaEnterobacter Sp.nutrient agar (NA)GC–MSno
ProkaryotaPantoea Sp.nutrient agar (NA)GC–MSno
ProkaryotaPseudomonas Sp.nutrient agar (NA)GC–MSno
ProkaryotaLentilactobacillus Buchnerimaize silageHS-SPME coupled with GC-TOF MSno
ProkaryotaLacticaseibacillus Paracaseimaize silageHS-SPME coupled with GC-TOF MSno
Microbacteriumtryptone soy (TS medium; Carl Roth, Karlsruhe, Germany)GC-QQQ-MSno