2-Propen-1-one, 3-(4-chlorophenyl)-1-(2-hydroxy-4-methoxyphenyl)-
Basic information
- CAS
56492-64-9- Standard SMILES
COc1ccc(C(=O)C=Cc2ccc(Cl)cc2)c(O)c1- InChIKey
PSHLSUYKYJMBFH-UHFFFAOYSA-N- Molecular formula
- C16H13ClO3
- Average molar mass
- 288.72 g/mol
- Monoisotopic mass
- 288.055322
Names & identifiers
- Preferred name
- 2-Propen-1-one, 3-(4-chlorophenyl)-1-(2-hydroxy-4-methoxyphenyl)-
- IUPAC
- 3-(4-chlorophenyl)-1-(2-hydroxy-4-methoxyphenyl)prop-2-en-1-one
Names & synonyms
3-(4-chlorophenyl)-1-(2-hydroxy-4-methoxyphenyl)prop-2-en-1-one56492-64-92-Propen-1-one, 3-(4-chlorophenyl)-1-(2-hydroxy-4-methoxyphenyl)-SCHEMBL7656535DTXSID00392371PD082509
Database identifiers
- CAS
56492-64-9- PubChem CID
- 3425554
- DTXSID
DTXSID00392371
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 348
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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