1-[4-Chloro-2-(2-Chlorobenzoyl)Phenyl]-5-(Morpholinomethyl)-1H-1,2,4-Triazole-3-Carboxylic Acid Monohydrochloride
[CAS# 67935-96-0]

Identification

• Name: 1-[4-Chloro-2-(2-Chlorobenzoyl)Phenyl]-5-(Morpholinomethyl)-1H-1,2,4-Triazole-3-Carboxylic Acid Monohydrochloride
• Synonyms: 1-[4-Chloro-2-(2-Chlorobenzoyl)Phenyl]-5-(Morpholinomethyl)-1,2,4-Triazole-3-Carboxylic Acid Hydrochloride; 1-[4-Chloro-2-[(2-Chlorophenyl)-Oxomethyl]Phenyl]-5-(Morpholinomethyl)-1,2,4-Triazole-3-Carboxylic Acid Hydrochloride; 1-[4-Chloro-2-(2-Chlorophenyl)Carbonyl-Phenyl]-5-(Morpholin-4-Ylmethyl)-1,2,4-Triazole-3-Carboxylic Acid Hydrochloride
• Molecular Formula: C₂₁H₁₉Cl₃N₄O₄
• Molecular Weight: 497.76
• CAS Registry Number: 67935-96-0
• EINECS: 267-815-3
• SMILES: [H+].C1=CC(=CC(=C1[N]2N=C(N=C2CN3CCOCC3)C(O)=O)C(=O)C4=CC=CC=C4Cl)Cl.[Cl-]
• InChI: 1S/C21H18Cl2N4O4.ClH/c22-13-5-6-17(15(11-13)19(28)14-3-1-2-4-16(14)23)27-18(24-20(25-27)21(29)30)12-26-7-9-31-10-8-26;/h1-6,11H,7-10,12H2,(H,29,30);1H
• InChIKey: NNWJPEOZCGYCLF-UHFFFAOYSA-N

Properties

• Boiling point: 723.3°C at 760 mmHg (Cal.)
• Flash point: 391.3°C (Cal.)