1-Methyl-5-Nitro-2-((Phenylsulfonyl)Methyl)-1H-Imidazole
[CAS# 116248-39-6]

Identification

• Name: 1-Methyl-5-Nitro-2-((Phenylsulfonyl)Methyl)-1H-Imidazole
• Synonyms: 1H-Imidazole, 1-Methyl-5-Nitro-2-((Phenylsulfonyl)Methyl)-; Brn 5978817; 1-Methyl-5-Nitro-2-((Phenylsulfonyl)Methyl)-1H-Imidazole
• Molecular Formula: C₁₁H₁₁N₃O₄S
• Molecular Weight: 281.29
• CAS Registry Number: 116248-39-6
• SMILES: C1=C([N](C(=N1)C[S](=O)(=O)C2=CC=CC=C2)C)[N+]([O-])=O
• InChI: 1S/C11H11N3O4S/c1-13-10(12-7-11(13)14(15)16)8-19(17,18)9-5-3-2-4-6-9/h2-7H,8H2,1H3
• InChIKey: ZRUQEDTXSPNOQI-UHFFFAOYSA-N

Properties

• Density: 1.457g/cm³ (Cal.)
• Boiling point: 564.288°C at 760 mmHg (Cal.)
• Flash point: 295.071°C (Cal.)