Basic information
- CAS
7468-22-6- Standard SMILES
CC(O)(c1ccccc1)C(C)(C(=O)O)c1ccccc1- InChIKey
LDYRXVGNACRGSQ-UHFFFAOYSA-N- Molecular formula
- C17H18O3
- Average molar mass
- 270.32 g/mol
- Monoisotopic mass
- 270.12559443
Names & identifiers
- Preferred name
- 3-Hydroxy-2-methyl-2,3-diphenylbutanoic acid
- IUPAC
- 3-hydroxy-2-methyl-2,3-diphenylbutanoic acid
Names & synonyms
7468-22-63-hydroxy-2-methyl-2,3-diphenylbutanoic acidNSC400750DTXSID90322243NSC-400750DS-0142423-hydroxy-2-methyl-2,3-diphenyl-butanoic acid
Database identifiers
- CAS
7468-22-6- PubChem CID
- 344064
- DTXSID
DTXSID90322243
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 342
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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