Basic information
- CAS
7146-73-8- Standard SMILES
O=C(O)c1ccc(NC(=O)C(Cl)Cl)cc1- InChIKey
FELCOLZFVJIGLE-UHFFFAOYSA-N- Molecular formula
- C9H7Cl2NO3
- Average molar mass
- 248.06 g/mol
- Monoisotopic mass
- 246.9802985
Names & identifiers
- Preferred name
- 4-[(Dichloroacetyl)amino]benzoic acid
- IUPAC
- 4-[(2,2-dichloroacetyl)amino]benzoic acid
Names & synonyms
4-[(dichloroacetyl)amino]benzoic acid7146-73-84-(2,2-DICHLOROACETAMIDO)BENZOIC ACID4-[(2,2-dichloroacetyl)amino]benzoic acidNSC23849Cambridge id 5279940SCHEMBL8354807DTXSID402820204-dichloro-acetylamino-benzoic acidNSC56411NSC-23849NSC-56411
Show more names
SR-01000203131SR-01000203131-1
Database identifiers
- CAS
7146-73-8- PubChem CID
- 229840
- DTXSID
DTXSID40282020
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…