Basic information
- CAS
7353-76-6- Standard SMILES
CC(=O)C1CC=CCC1- InChIKey
DJCDJUMICVADAG-UHFFFAOYSA-N- Molecular formula
- C8H12O
- Average molar mass
- 124.18 g/mol
- Monoisotopic mass
- 124.088815
Names & identifiers
- Preferred name
- 4-Acetylcyclohexene
- IUPAC
- 1-cyclohex-3-en-1-ylethanone
Names & synonyms
4-Acetylcyclohexene7353-76-6Ketone, 3-cyclohexen-1-yl methylEthanone, 1-(3-cyclohexen-1-yl)-.DELTA.3-Cyclohexenyl methyl ketoneDTXSID30286330RefChem:97643delta3-Cyclohexenyl methyl ketoneDTXCID50237480DJCDJUMICVADAG-UHFFFAOYSA-N1-cyclohex-3-en-1-ylethanone1-(cyclohex-3-en-1-yl)ethan-1-one
Show more names
1-(Cyclohex-3-enyl)ethanoneNSC-448071-(3-Cyclohexen-1-yl)ethanone1-Acetyl-3-cyclohexene6D8GU34KLDSCHEMBL11376811-(1-cyclohex-3-enyl)-ethanone1-(3-Cyclohexen-1-yl)ethanone #
Database identifiers
- CAS
7353-76-6- PubChem CID
- 239587
- DTXSID
DTXSID30286330- UNII
- 6D8GU34KLD
- EC Number
- 872-212-9
- Nikkaji
- J100.509J
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 136
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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