Thiourea, N-(imino((5-nitro-1H-benzimidazol-2-yl)amino)methyl)-N'-(2-methylphenyl)-

Base Information

• Chemical Name: Thiourea, N-(imino((5-nitro-1H-benzimidazol-2-yl)amino)methyl)-N'-(2-methylphenyl)-
• CAS No.: 113367-99-0
• Molecular Formula: C16H15 N7 O2 S
• Molecular Weight: 369.401
• DSSTox Substance ID: DTXSID60150373
• Mol file: 113367-99-0.mol

Synonyms:1-((5-Nitro-2-benzimidazolyl)amidino)-2-thio-3-o-tolylurea;Urea, 1-((5-nitro-2-benzimidazolyl)amidino)-2-thio-3-o-tolyl-;Thiourea, N-(imino((5-nitro-1H-benzimidazol-2-yl)amino)methyl)-N'-(2-methylphenyl)-;113367-99-0;DTXSID60150373;LS-160566

Chemical Property of Thiourea, N-(imino((5-nitro-1H-benzimidazol-2-yl)amino)methyl)-N'-(2-methylphenyl)-

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 616.2°Cat760mmHg
• Flash Point: 326.5°C
• Density: 1.55g/cm³
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 369.10079392
• Heavy Atom Count: 26
• Complexity: 567

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1NC(=S)N=C(N)NC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]
• Isomeric SMILES: CC1=CC=CC=C1NC(=S)/N=C(\N)/NC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-]

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