1-[2-(4-Chlorophenyl)Ethyl]-7-Sulfamoylbenzimidazole-5-Carboxylic Acid
[CAS# 72020-21-4]

Identification

• Name: 1-[2-(4-Chlorophenyl)Ethyl]-7-Sulfamoylbenzimidazole-5-Carboxylic Acid
• Synonyms: 1-[2-(4-Chlorophenyl)Ethyl]-7-Sulfamoyl-Benzimidazole-5-Carboxylic Acid; 1-[2-(4-Chlorophenyl)Ethyl]-7-Sulfamoyl-5-Benzimidazolecarboxylic Acid; 1H-Benzimidazole-5-Carboxylic Acid, 7-(Aminosulfonyl)-1-(2-(4-Chlorophenyl)Ethyl)-
• Molecular Formula: C₁₆H₁₄ClN₃O₄S
• Molecular Weight: 379.82
• CAS Registry Number: 72020-21-4
• SMILES: C2=NC1=CC(=CC(=C1[N]2CCC3=CC=C(C=C3)Cl)[S](=O)(=O)N)C(=O)O
• InChI: 1S/C16H14ClN3O4S/c17-12-3-1-10(2-4-12)5-6-20-9-19-13-7-11(16(21)22)8-14(15(13)20)25(18,23)24/h1-4,7-9H,5-6H2,(H,21,22)(H2,18,23,24)
• InChIKey: KBIGFUOLZNQEKD-UHFFFAOYSA-N

Properties

• Density: 1.576g/cm³ (Cal.)
• Boiling point: 689.961°C at 760 mmHg (Cal.)
• Flash point: 371.075°C (Cal.)