2-[2-Methyl-5-Nitro-3-(Phenylmethyl)Imidazol-4-Yl]Sulfonylacetamide
[CAS# 110579-18-5]

Identification

• Name: 2-[2-Methyl-5-Nitro-3-(Phenylmethyl)Imidazol-4-Yl]Sulfonylacetamide
• Synonyms: 2-[[2-Methyl-5-Nitro-3-(Phenylmethyl)-4-Imidazolyl]Sulfonyl]Acetamide; 2-[3-(Benzyl)-2-Methyl-5-Nitro-Imidazol-4-Yl]Sulfonylacetamide; 2-[2-Methyl-5-Nitro-3-(Phenylmethyl)Imidazol-4-Yl]Sulfonylethanamide
• Molecular Formula: C₁₃H₁₄N₄O₅S
• Molecular Weight: 338.34
• CAS Registry Number: 110579-18-5
• SMILES: C2=C(C[N]1C(=C(N=C1C)[N+]([O-])=O)[S](=O)(=O)CC(=O)N)C=CC=C2
• InChI: 1S/C13H14N4O5S/c1-9-15-12(17(19)20)13(23(21,22)8-11(14)18)16(9)7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H2,14,18)
• InChIKey: STEWSPJNLNKNKN-UHFFFAOYSA-N

Properties

• Density: 1.543g/cm³ (Cal.)
• Boiling point: 684.001°C at 760 mmHg (Cal.)
• Flash point: 367.47°C (Cal.)