alpha-Allyloxymethyl-2-Nitro-1H-Imidazole-1-Ethanol
[CAS# 21787-89-3]

Identification

• Name: alpha-Allyloxymethyl-2-Nitro-1H-Imidazole-1-Ethanol
• Synonyms: 1-Allyloxy-3-(2-Nitroimidazol-1-Yl)Propan-2-Ol; 1-Allyloxy-3-(2-Nitro-1-Imidazolyl)Propan-2-Ol; 1-(2-Nitroimidazol-1-Yl)-3-Prop-2-Enoxy-Propan-2-Ol
• Molecular Formula: C₉H₁₃N₃O₄
• Molecular Weight: 227.22
• CAS Registry Number: 21787-89-3
• SMILES: C1=CN=C([N]1CC(O)COCC=C)[N+]([O-])=O
• InChI: 1S/C9H13N3O4/c1-2-5-16-7-8(13)6-11-4-3-10-9(11)12(14)15/h2-4,8,13H,1,5-7H2
• InChIKey: ZGENSUYRNWPOET-UHFFFAOYSA-N

Properties

• Density: 1.315g/cm³ (Cal.)
• Boiling point: 446.335°C at 760 mmHg (Cal.)
• Flash point: 223.736°C (Cal.)