Basic information
- CAS
1019345-46-0- Standard SMILES
O=C(Nc1cc(F)ccc1C(=O)O)c1ccc(Cl)cc1- InChIKey
CPZJKOAIAQMCKB-UHFFFAOYSA-N- Molecular formula
- C14H9ClFNO3
- Average molar mass
- 293.68 g/mol
- Monoisotopic mass
- 293.025499
Names & identifiers
- Preferred name
- 2-(4-Chlorobenzamido)-4-fluorobenzoic acid
- IUPAC
- 2-[(4-chlorobenzoyl)amino]-4-fluorobenzoic acid
Names & synonyms
DTXSID501241026AKOS0002002651019345-46-02-[(4-chlorobenzoyl)amino]-4-fluorobenzoic acid2-(4-CHLOROBENZAMIDO)-4-FLUOROBENZOIC ACID
Database identifiers
- CAS
1019345-46-0- PubChem CID
- 25750122
- DTXSID
DTXSID501241026
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 371
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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