Methyl 1-Benzyl-5-Chloro-Triazole-4-Carboxylate
[CAS# 90997-14-1]

Identification

• Name: Methyl 1-Benzyl-5-Chloro-Triazole-4-Carboxylate
• Synonyms: 5-Chloro-1-(Phenylmethyl)-4-Triazolecarboxylic Acid Methyl Ester; 1-(Benzyl)-5-Chloro-Triazole-4-Carboxylic Acid Methyl Ester; Methyl 5-Chloro-1-(Phenylmethyl)-1,2,3-Triazole-4-Carboxylate
• Molecular Formula: C₁₁H₁₀ClN₃O₂
• Molecular Weight: 251.67
• CAS Registry Number: 90997-14-1
• SMILES: C1=C(C=CC=C1)C[N]2N=NC(=C2Cl)C(=O)OC
• InChI: 1S/C11H10ClN3O2/c1-17-11(16)9-10(12)15(14-13-9)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
• InChIKey: HIOCTRANYNIBAN-UHFFFAOYSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 412.805°C at 760 mmHg (Cal.)
• Flash point: 203.457°C (Cal.)