Basic information
- CAS
5333-39-1- Standard SMILES
COC(=O)C(CC(=O)c1ccc(-c2ccccc2)cc1)c1ccccc1- InChIKey
KEJILQKPDRGJCH-UHFFFAOYSA-N- Molecular formula
- C23H20O3
- Average molar mass
- 344.4 g/mol
- Monoisotopic mass
- 344.1412445
Names & identifiers
- Preferred name
- Methyl 4-oxo-2-phenyl-4-(4-phenylphenyl)butanoate
- IUPAC
- methyl 4-oxo-2-phenyl-4-(4-phenylphenyl)butanoate
Names & synonyms
methyl 4-oxo-2-phenyl-4-(4-phenylphenyl)butanoate5333-39-1NSC2402DTXSID80277455NSC-2402Methyl 4-([1,1'-biphenyl]-4-yl)-4-oxo-2-phenylbutanoate3-(4-BIPHENYLYLCARBONYL)-2-PHENYLPROPANOIC ACID, METHYL ESTER
Database identifiers
- CAS
5333-39-1- PubChem CID
- 220115
- DTXSID
DTXSID80277455
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 452
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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