Benzoic acid, 5-(((3-chlorophenyl)amino)carbonyl)-2-hydroxy-, ethyl ester
Basic information
- CAS
38507-81-2- Standard SMILES
CCOC(=O)c1cc(C(=O)Nc2cccc(Cl)c2)ccc1O- InChIKey
SOXWIYZQKWYQPU-UHFFFAOYSA-N- Molecular formula
- C16H14ClNO4
- Average molar mass
- 319.74 g/mol
- Monoisotopic mass
- 319.0611356
Names & identifiers
- Preferred name
- Benzoic acid, 5-(((3-chlorophenyl)amino)carbonyl)-2-hydroxy-, ethyl ester
- IUPAC
- ethyl 5-[(3-chlorophenyl)carbamoyl]-2-hydroxybenzoate
Names & synonyms
BRN 306546738507-81-2Benzoic acid, 5-(((3-chlorophenyl)amino)carbonyl)-2-hydroxy-, ethyl esterEthyl 5-(((3-chlorophenyl)amino)carbonyl)-2-hydroxybenzoateDTXSID60191827RefChem:327647DTXCID00114318ethyl 5-[(3-chlorophenyl)carbamoyl]-2-hydroxybenzoate
Database identifiers
- CAS
38507-81-2- PubChem CID
- 217290
- DTXSID
DTXSID60191827
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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