N-[4-(5-Amino-2H-1,2,4-Triazol-3-Yl)Phenyl]Acetamide Hydrate
[CAS# 73953-88-5]

Identification

• Name: N-[4-(5-Amino-2H-1,2,4-Triazol-3-Yl)Phenyl]Acetamide Hydrate
• Synonyms: N-[4-(5-Amino-2H-1,2,4-Triazol-3-Yl)Phenyl]Ethanamide Hydrate; 1H-1,2,4-Triazole, 5-(P-Acetamidophenyl)-3-Amino-, Hydrate; 5-(P-Acetamidophenyl)-3-Amino-1H-1,2,4-Triazole Hydrate
• Molecular Formula: C₁₀H₁₃N₅O₂
• Molecular Weight: 235.25
• CAS Registry Number: 73953-88-5
• SMILES: C2=C(C1=NC(=N[NH]1)N)C=CC(=C2)NC(=O)C.O
• InChI: 1S/C10H11N5O.H2O/c1-6(16)12-8-4-2-7(3-5-8)9-13-10(11)15-14-9;/h2-5H,1H3,(H,12,16)(H3,11,13,14,15);1H2
• InChIKey: RHAWINLTXMRKRL-UHFFFAOYSA-N

Properties

• Boiling point: 662.1°C at 760 mmHg (Cal.)
• Flash point: 354.2°C (Cal.)