Results for:
PubChem ID: 521238

Octan-3-yl Acetate

Mass-Spectra

Compound Details

Synonymous names
3-Octyl acetate
3-Octanol, acetate
4864-61-3
octan-3-yl acetate
3-Octanol acetate
Oct-3-yl ethanoate
Amyl ethyl carbinyl acetate
1-Ethyl hexyl acetate
3-Octanol, 3-acetate
FEMA No. 3583
3-Octyl acetate (natural)
UNII-8M41FR2J6W
(+/-)-3-Octyl acetate
8M41FR2J6W
3-OCTANYL ACETATE
3-OCTYLACETATE
EINECS 225-471-1
Octan-3-ol acetate
ethyl acetate=n-hexane
3-ACETOXYOCTANE
(+)-3-octyl acetate
1-Ethylhexyl acetate #
SCHEMBL112743
3-OCTYL ACETATE [FCC]
3-OCTYL ACETATE [FHFI]
Acetic acid, 1-ethylhexyl ester
FEMA 3583
DTXSID30863463
(+/-)-3-ACETOXYOCTANE
CHEBI:179545
3-OCTYL ACETATE, (+/-)-
3-Octyl acetate, >=98%, FCC, FG
NS00045125
3-Octyl acetate, natural (US), >=97%, FG
Q27270741
Microorganism:

No

IUPAC nameoctan-3-yl acetate
SMILESCCCCCC(CC)OC(=O)C
InchiInChI=1S/C10H20O2/c1-4-6-7-8-10(5-2)12-9(3)11/h10H,4-8H2,1-3H3
FormulaC10H20O2
PubChem ID521238
Molweight172.26
LogP3.4
Atoms12
Bonds7
H-bond Acceptor2
H-bond Donor0
Chemical Classificationesters
CHEBI-ID179545
Supernatural-IDSN0355317

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
EukaryotaChaetomium IndicumNAMoisan et al. 2021
EukaryotaPenicillium Expansumn/aLandes-Gesundheitsamt Stuttgart, GermanyMatysik et al. 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
EukaryotaChaetomium Indicum1/5th PDA mediumGC-MSno
EukaryotaPenicillium Expansumwett wall papern/ano