6-(4-Chlorophenyl)-6-hydroxy-6-phenylhexane-2,4-dione
Basic information
- CAS
7248-82-0- Standard SMILES
CC(=O)CC(=O)CC(O)(c1ccccc1)c1ccc(Cl)cc1- InChIKey
AUYCSFLQMAZHPA-UHFFFAOYSA-N- Molecular formula
- C18H17ClO3
- Average molar mass
- 316.8 g/mol
- Monoisotopic mass
- 316.0866221
Names & identifiers
- Preferred name
- 6-(4-Chlorophenyl)-6-hydroxy-6-phenylhexane-2,4-dione
- IUPAC
- 6-(4-chlorophenyl)-6-hydroxy-6-phenylhexane-2,4-dione
- English name
- 6-(4-chlorophenyl)-6-hydroxy-6-phenyl-hexane-2,4-dione
- Molecular formula
- C18H17ClO3
- Molecular weight
- 0
Names & synonyms
7248-82-06-(4-chlorophenyl)-6-hydroxy-6-phenylhexane-2,4-dioneNSC46489DTXSID50286559NSC-464896-(4-chlorophenyl)-6-hydroxy-6-phenyl-hexane-2,4-dione
Database identifiers
- CAS
7248-82-0- PubChem CID
- 240347
- DTXSID
DTXSID50286559
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 395
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Related reactions
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Compound notes
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