2-Cyclohexen-1-one, 2-methoxy-4-methyl-4-phenyl-
Basic information
- CAS
113660-62-1- Standard SMILES
COC1=CC(C)(c2ccccc2)CCC1=O- InChIKey
JGZNQPFUEQYNKT-UHFFFAOYSA-N- Molecular formula
- C14H16O2
- Average molar mass
- 216.27 g/mol
- Monoisotopic mass
- 216.11502975
Names & identifiers
- Preferred name
- 2-Cyclohexen-1-one, 2-methoxy-4-methyl-4-phenyl-
- IUPAC
- 2-methoxy-4-methyl-4-phenylcyclohex-2-en-1-one
Names & synonyms
113660-62-12-Cyclohexen-1-one, 2-methoxy-4-methyl-4-phenyl-DTXSID10341739RefChem:259775DTXCID702928192-Methoxy-4-methyl-4-phenyl-2-cyclohexen-1-oneJGZNQPFUEQYNKT-UHFFFAOYSA-N5-Methoxy-1-methyl-2,3-dihydro[1,1'-biphenyl]-4(1H)-one
Database identifiers
- CAS
113660-62-1- PubChem CID
- 575418
- DTXSID
DTXSID10341739- Nikkaji
- J599.798D
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 300
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Compound notes
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