3-(2-Benzyloxy-5-methylphenyl) 3-phenyl propionic acid
Basic information
- Standard SMILES
Cc1ccc(OCc2ccccc2)c(C(CC(=O)O)c2ccccc2)c1- InChIKey
OQXLUJUTHYBTHX-UHFFFAOYSA-N- Molecular formula
- C23H22O3
- Average molar mass
- 346.4 g/mol
- Monoisotopic mass
- 346.15689456
Names & identifiers
- Preferred name
- 3-(2-Benzyloxy-5-methylphenyl) 3-phenyl propionic acid
- IUPAC
- 3-(5-methyl-2-phenylmethoxyphenyl)-3-phenylpropanoic acid
Names & synonyms
(3R)-3-[2-(benzyloxy)-5-methylphenyl]-3-phenylpropanoic acidSCHEMBL1990350OQXLUJUTHYBTHX-UHFFFAOYSA-N3-(2-benzyloxy-5-methylphenyl) 3-phenyl propionic acid
Database identifiers
- PubChem CID
- 67239288
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 423
Related reactions
1 records
Compound notes
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