Basic information
- Standard SMILES
CCOC(=O)c1cc(-c2ccc(F)cc2F)ccc1O- InChIKey
YHZSWAZWTXVQLV-UHFFFAOYSA-N- Molecular formula
- C15H12F2O3
- Average molar mass
- 278.25 g/mol
Names & identifiers
- Preferred name
- Ethyl 2',4'-Difluoro-4-hydroxy[1,1'-biphenyl]-3-carboxylate
- IUPAC
- ethyl 5-(2,4-difluorophenyl)-2-hydroxybenzoate
Names & synonyms
Diflunisal Ethyl Ester126093-86-5Ethyl 2',4'-Difluoro-4-hydroxy[1,1'-biphenyl]-3-carboxylate2',?4'-Difluoro-?4-?hydroxy-[1,?1'-?biphenyl]?-?3-?carboxylic Acid Ethyl EsterDiflunisal Impurity 7SCHEMBL1818476CHEMBL4572832YHZSWAZWTXVQLV-UHFFFAOYSA-Nethyl 5-(2,4-difluorophenyl)salicylateethyl 2',4'-difluoro-4-hydroxybiphenyl-3-carboxylateethyl 2',4'-difluoro-4-hydroxy-[1,1'-biphenyl]-3-carboxylateDiflunisal Ethyl Ester; 2',4'-Difluoro-4-hydroxy-[1,1'-biphenyl]-3-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 23078331
- ChEMBL
CHEMBL4572832
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 337
Related reactions
12 records
Compound notes
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