1-[3-(5-Nitro-2-Furyl)-1H-1,2,4-Triazol-1-Yl]Ethanone
[CAS# 5019-61-4]

Identification

• Name: 1-[3-(5-Nitro-2-Furyl)-1H-1,2,4-Triazol-1-Yl]Ethanone
• Synonyms: 1-(3-(5-Nitrofuran-2-yl)-1H-1,2,4-triazol-1-yl)ethanone; 1-Acetyl-3-(5-nitro-2-furyl)-1H-1,2,4-triazole #
• Molecular Formula: C₈H₆N₄O₄
• Molecular Weight: 222.16
• CAS Registry Number: 5019-61-4
• SMILES: O=[N+]([O-])c2oc(c1nn(C(=O)C)cn1)cc2
• InChI: 1S/C8H6N4O4/c1-5(13)11-4-9-8(10-11)6-2-3-7(16-6)12(14)15/h2-4H,1H3
• InChIKey: FCMWZURFINDRRP-UHFFFAOYSA-N

Properties

• Density: 1.672g/cm³ (Cal.)
• Boiling point: 437.162°C at 760 mmHg (Cal.)
• Flash point: 218.188°C (Cal.)