Benzoic acid, 4-(((4-chlorophenoxy)acetyl)amino)-
Basic information
- CAS
54393-15-6- Standard SMILES
O=C(COc1ccc(Cl)cc1)Nc1ccc(C(=O)O)cc1- InChIKey
QIOBRXCJIOTMBM-UHFFFAOYSA-N- Molecular formula
- C15H12ClNO4
- Average molar mass
- 305.71 g/mol
- Monoisotopic mass
- 305.0454856
Names & identifiers
- Preferred name
- Benzoic acid, 4-(((4-chlorophenoxy)acetyl)amino)-
- IUPAC
- 4-[[2-(4-chlorophenoxy)acetyl]amino]benzoic acid
Names & synonyms
Benzoic acid, 4-(((4-chlorophenoxy)acetyl)amino)-54393-15-64-(((4-Chlorophenoxy)acetyl)amino)benzoic acidCHEMBL427450DTXSID60202780AKOS0001065274-[2-(4-CHLOROPHENOXY)ACETAMIDO]BENZOIC ACID
Database identifiers
- CAS
54393-15-6- PubChem CID
- 148677
- DTXSID
DTXSID60202780- ChEMBL
CHEMBL427450
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 361
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Compound notes
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