Basic information
- CAS
52182-26-0- Standard SMILES
COc1cccc(C(=O)C=Cc2ccc(C)cc2)c1- InChIKey
NHORRVWNYQDPID-UHFFFAOYSA-N- Molecular formula
- C17H16O2
- Average molar mass
- 252.31 g/mol
- Monoisotopic mass
- 252.11502975
Names & identifiers
- Preferred name
- 2-Propen-1-one, 1-(3-methoxyphenyl)-3-(4-methylphenyl)-
- IUPAC
- 1-(3-methoxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one
Names & synonyms
52182-26-01-(3-methoxyphenyl)-3-(4-methylphenyl)prop-2-en-1-one2-Propen-1-one, 1-(3-methoxyphenyl)-3-(4-methylphenyl)-SCHEMBL9341818DTXSID40387084AKOS0170857961-(3-methoxyphenyl)-3-(p-tolyl)prop-2-en-1-one
Database identifiers
- CAS
52182-26-0- PubChem CID
- 2880331
- DTXSID
DTXSID40387084
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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