Basic information
- Standard SMILES
CCCCOC(=O)CC(C)c1ccc(-c2ccc(F)cc2F)cc1- InChIKey
CFROXBRBQSNHRQ-UHFFFAOYSA-N- Molecular formula
- C20H22F2O2
- Average molar mass
- 332.4 g/mol
Names & identifiers
- Preferred name
- 3-(2',4'-Difluoro-4-biphenylyl)butyric acid n-butyl ester
- IUPAC
- butyl 3-[4-(2,4-difluorophenyl)phenyl]butanoate
Names & synonyms
SCHEMBL11548014CFROXBRBQSNHRQ-UHFFFAOYSA-N3-(2',4'-difluoro-4-biphenylyl)butyric acid n-butyl ester
Database identifiers
- PubChem CID
- 53718641
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 380
Related reactions
2 records
Compound notes
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