Basic information
- Standard SMILES
CC(C)(C)OC(=O)C[C@@H](Cc1ccc(-c2ccccc2)cc1)C(=O)O- InChIKey
JMGUHVFNUALJTQ-GOSISDBHSA-N- Molecular formula
- C21H24O4
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.16745924
Names & identifiers
- Preferred name
- (R)-2-(biphenyl-4-ylmethyl)-4-tert-butoxy-4-oxobutanoic acid
- IUPAC
- (2R)-4-[(2-methylpropan-2-yl)oxy]-4-oxo-2-[(4-phenylphenyl)methyl]butanoic acid
Names & synonyms
SCHEMBL1912534JMGUHVFNUALJTQ-GOSISDBHSA-N(R)-2-(biphenyl-4-ylmethyl)-4-tert-butoxy-4-oxobutanoic acid
Database identifiers
- PubChem CID
- 59607655
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 437
Related reactions
5 records
Compound notes
Loading…