Basic information
- CAS
768-48-9- Standard SMILES
CC(=O)OC1C=CC(=O)C1- InChIKey
YNCKAQVPQJWLJW-UHFFFAOYSA-N- Molecular formula
- C7H8O3
- Average molar mass
- 140.14 g/mol
- Monoisotopic mass
- 140.04734411
Names & identifiers
- Preferred name
- 4-Oxocyclopent-2-en-1-yl acetate
- IUPAC
- (4-oxocyclopent-2-en-1-yl) acetate
- English name
- 4-Acetoxy-2-cyclopenten-1-one
- Molecular formula
- C7H8O3
- Molecular weight
- 140.14
Names & synonyms
768-48-94-oxocyclopent-2-en-1-yl acetateDTXSID90321812RefChem:295279DTXCID902729314-Oxocyclopent-2-enyl acetate(4-oxocyclopent-2-en-1-yl) acetate4-Oxo-2-cyclopenten-1-yl AcetateMFCD21608075NSC3821244-ACETOXY-2-CYCLOPENTEN-1-ONE4-oxo-2-cyclopentenyl acetate
Show more names
4-(Acetyloxy)-2-cyclopenten-1-one2-Cyclopenten-1-one, 4-(acetyloxy)-
SCHEMBL28160784-acetoxycyclopent-2-en-1-one4-oxocyclopent-2-en-1-ylacetate2-Cyclopenten-1-one,4-(acetyloxy)-AKOS030627881NSC-382124SB40888AS-44195
Database identifiers
- CAS
768-48-9- PubChem CID
- 343117
- DTXSID
DTXSID90321812- Nikkaji
- J1.151.145G
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 223 · 223.0±40.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
Chemistry & industry
Suppliers4 total
上海九芳科技有限公司021-61150629 15921749159 · [email protected]
Wuhan EnTai Technology Development Co,.Ltd86-27-82330560 · [email protected]
成都沸柏医药科技有限公司028-84641798 18782128315 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
Related reactions
6 records
Compound notes
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