5-(Aminosulfonyl)-2-chlorobenzoic acid
Properties
- Molecular formula
- C7H6ClNO4S
- Molar mass
- 235.64 g/mol
- Exact mass
- 234.9706 Da
- logP
- 0.69Crippen estimate
- Polar surface area
- 97.5 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 2
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
97-04-1SMILES
NS(=O)(=O)c1ccc(Cl)c(C(=O)O)c1InChIKey
LWDSANAOYPHQAW-UHFFFAOYSA-NInChI
InChI=1S/C7H6ClNO4S/c8-6-2-1-4(14(9,12)13)3-5(6)7(10)11/h1-3H,(H,10,11)(H2,9,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Benzoic acid, 5-(aminosulfonyl)-2-chloro-
- Benzoic acid, 2-chloro-5-sulfamoyl-
- 2-Chloro-5-sulfamoylbenzoic acid
- 2-Chloro-5-aminosulfonylbenzoic acid
Work with 5-(Aminosulfonyl)-2-chlorobenzoic acid
Similar compounds
2-Amino-5-(aminosulfonyl)benzoic acid137-65-567 % similar
5-(Aminosulfonyl)-2,4-dichlorobenzoic acid2736-23-463 % similar
5-(Aminosulfonyl)-2-methoxybenzoic acid22117-85-760 % similar
2,5-Dichlorobenzoic acid50-79-357 % similar
5-Amino-2-chlorobenzoic acid89-54-356 % similar
4-Carboxybenzenesulfonamide138-41-055 % similar
4-Chloro-5-sulfamoylsalicylic acid14556-98-055 % similar
2-Chloro-5-hydroxybenzoic acid56961-30-954 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.