Basic information
- Standard SMILES
O=C(OC(c1ccccc1)c1ccccc1)c1ccc(O)c(O)c1- InChIKey
KOCBEVRQUBIATG-UHFFFAOYSA-N- Molecular formula
- C20H16O4
- Average molar mass
- 320.3 g/mol
Names & identifiers
- Preferred name
- Benzhydryl protocatechuate
- IUPAC
- benzhydryl 3,4-dihydroxybenzoate
Names & synonyms
benzhydryl protocatechuateSCHEMBL9513059KOCBEVRQUBIATG-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 20064320
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 380
Related reactions
2 records
Compound notes
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