Basic information
- CAS
408537-50-8- Standard SMILES
O=C(Oc1ccccc1-c1ccccc1)c1ccccc1O- InChIKey
POIVJPHDHZNAQB-UHFFFAOYSA-N- Molecular formula
- C19H14O3
- Average molar mass
- 290.3 g/mol
- Monoisotopic mass
- 290.0942943
Names & identifiers
- Preferred name
- [1,1'-Biphenyl]-2-yl salicylate
- IUPAC
- (2-phenylphenyl) 2-hydroxybenzoate
- English name
- Benzoic acid, 2-hydroxy-, [1,1'-biphenyl]-2-yl ester
- Molecular formula
- C19H14O3
- Molecular weight
- 290.31
Names & synonyms
biphenyl salicylateSCHEMBL9306963[1,1'-biphenyl]-2-yl salicylateBenzoic acid, 2-hydroxy-, [1,1'-biphenyl]-2-yl ester
Database identifiers
- CAS
408537-50-8- PubChem CID
- 44718982
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 362
Physicochemical properties
- Boiling point
- 480.7 · 480.7±28.0 °C(Predicted)
- Density
- 1.227 · 1.227±0.06 g/cm3(Predicted)
- pka
- 7.83 · 7.83±0.30(Predicted)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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