5-(2-Chloro-6-Methylphenyl)Sulfonyl-1-Methyl-4-Nitroimidazole
[CAS# 131134-91-3]

Identification

• Name: 5-(2-Chloro-6-Methylphenyl)Sulfonyl-1-Methyl-4-Nitroimidazole
• Synonyms: 5-(2-Chloro-6-Methyl-Phenyl)Sulfonyl-1-Methyl-4-Nitro-Imidazole; 1-Methyl-4-Nitro-5-Imidazolyl-2-Chloro-6-Methylphenyl Sulfone; 1H-Imidazole, 5-((2-Chloro-6-Methylphenyl)Sulfonyl)-1-Methyl-4-Nitro-
• Molecular Formula: C₁₁H₁₀ClN₃O₄S
• Molecular Weight: 315.73
• CAS Registry Number: 131134-91-3
• SMILES: C2=NC(=C([S](=O)(=O)C1=C(C=CC=C1Cl)C)[N]2C)[N+]([O-])=O
• InChI: 1S/C11H10ClN3O4S/c1-7-4-3-5-8(12)9(7)20(18,19)11-10(15(16)17)13-6-14(11)2/h3-6H,1-2H3
• InChIKey: FMIVUKKSIFSQMV-UHFFFAOYSA-N

Properties

• Density: 1.567g/cm³ (Cal.)
• Boiling point: 595.14°C at 760 mmHg (Cal.)
• Flash point: 313.729°C (Cal.)