Basic information
- CAS
1450-65-3- Standard SMILES
CC1CCC(=Cc2ccccc2)C1=O- InChIKey
RCJDUFCDDWCQAA-UHFFFAOYSA-N- Molecular formula
- C13H14O
- Average molar mass
- 186.25 g/mol
- Monoisotopic mass
- 186.10446507
Names & identifiers
- Preferred name
- 2-Benzylidene-5-methylcyclopentan-1-one
- IUPAC
- 2-benzylidene-5-methylcyclopentan-1-one
Names & synonyms
1450-65-32-Benzylidene-5-methylcyclopentan-1-oneSCHEMBL9047403DTXSID70710104
Database identifiers
- CAS
1450-65-3- PubChem CID
- 54259342
- DTXSID
DTXSID70710104
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 246
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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