Results for:
PubChem ID: 7918

Acetyl Acetate

Compound Details

Synonymous names
ACETIC ANHYDRIDE
Acetyl acetate
108-24-7
Acetanhydride
Ethanoic anhydride
Acetyl anhydride
Acetic acid, anhydride
Acetyl oxide
acetic acid anhydride
Acetic oxide
Acetyl ether
Anhydride acetique
Anidride acetica
Octowy bezwodnik
Azijnzuuranhydride
Essigsaeureanhydrid
Ethanoic anhydrate
Anhydrid kyseliny octove
Ac2O
ethanoyl ethanoate
(CH3CO)2O
Caswell No. 003A
HSDB 233
CCRIS 688
Acetic acid, 1,1'-anhydride
EINECS 203-564-8
UNII-2E48G1QI9Q
EPA Pesticide Chemical Code 044007
BRN 0385737
2E48G1QI9Q
DTXSID0024395
CHEBI:36610
Acetic anhydride-1,1'-13C2,d6
(MeCO)2O
DTXCID704395
285977-77-7
EC 203-564-8
4-02-00-00386 (Beilstein Handbook Reference)
ACETIC ANHYDRIDE-13C4, D6
ACETIC ANHYDRIDE (1,1'-13C2)
285977-78-8
ACETIC ANHYDRIDE (II)
ACETIC ANHYDRIDE [II]
MFCD00008705
Octowy bezwodnik [Polish]
Azijnzuuranhydride [Dutch]
Anidride acetica [Italian]
Anhydride acetique [French]
Essigsaeureanhydrid [German]
Anhydrid kyseliny octove [Czech]
UN1715
acetanhydrid
acetic anhydrid
actic anhydride
diacetyl oxide
acetic-anhydride
acetic, anhydride
AcOAc
Acetyltrimethyl-Silane
acetic acetic anhydride
Acetic anhydride [UN1715] [Corrosive]
acetic acid acetyl ester
SCHEMBL523
Acetic anhydride ACS grade
acetic acid-acetic anhydride
(Ac)2O
Acetic anhydride, >=99%
Acetic anhydride, 99.5%
Pesticide Code: 044007
MLS002454384
ACETIC ANHYDRIDE [MI]
Acetic anhydride, ACS, 97%
ACETIC ANHYDRIDE [HSDB]
CHEMBL1305819
HMS3039J03
BCP20665
Acetic anhydride, JIS special grade
Tox21_200278
STL264203
AKOS015915487
MCULE-9184217748
UN 1715
NCGC00091802-01
NCGC00091802-02
NCGC00257832-01
Acetic anhydride, reagent grade, >=98%
BP-24367
BP-31054
CAS-108-24-7
SMR001372001
Acetic anhydride [UN1715] [Corrosive]
Acetic anhydride, ACS reagent, >=98.0%
Acetic anhydride, ReagentPlus(R), >=99%
NS00004253
Acetic anhydride, p.a., ACS reagent, 97.0%
Acetic anhydride, SAJ first grade, >=93.0%
A801828
Acetic anhydride, Lonza quality, >=99.5% (GC)
Q407775
Acetic anhydride, for GC derivatization, >=99.0%
InChI=1/C4H6O3/c1-3(5)7-4(2)6/h1-2H
Acetic anhydride, p.a., ACS reagent, reag. ISO, reag. Ph. Eur., 99.0%
Acetic anhydride, puriss. p.a., ACS reagent, reag. ISO, reag. Ph. Eur., >=99% (GC)
Capping B1 (40 % acetic anhydride in acetonitrile, for AKTA oligopilottrade mark) NC-0806, GL45 thread emp Biotech GmbH
Microorganism:

Yes

IUPAC nameacetyl acetate
SMILESCC(=O)OC(=O)C
InchiInChI=1S/C4H6O3/c1-3(5)7-4(2)6/h1-2H3
FormulaC4H6O3
PubChem ID7918
Molweight102.09
LogP-0.1
Atoms7
Bonds2
H-bond Acceptor3
H-bond Donor0
Chemical Classificationesters anhydrides
CHEBI-ID36610
Supernatural-IDSN0408579

mVOC Specific Details

Boiling Point
DegreeReference
139.5 °C peer reviewed
Volatilization
The half-life for the hydrolysis of acetic anhydride is 4.4 minutes(SRC), based on a rate constant of 0.002625 1/sec at 25 °C(1). Hydrolysis is expected to be the predominate fate of acetic anhydride in moist soil and water (SRC). The potential for volatilization of acetic anhydride from dry soil surfaces may exist(SRC) based upon a vapor pressure of 5.1 mm Hg(2).
Soil Adsorption
The half-life for the hydrolysis of acetic anhydride is 4.4 minutes(SRC), based on a rate constant of 0.002625 1/sec at 25 °C(1). Hydrolysis is expected to be the predominate fate of acetic anhydride in soil(SRC).

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
ProkaryotaLactobacillus PlantarumNAYang et al. 2022
Saccharomyces CerevisiaeQin et al. 2024
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
ProkaryotaLactobacillus Plantarumginkgo biloba kernel juicetriple quadrupole GC-MSno
Saccharomyces Cerevisiaefermentation of mulberry wineHS-SPME-GC-MSno