2-((Dihydro-2(3H)-thienylidene)methyl)-1-methyl-5-nitro-1H-imidazole S,S-dioxide

Base Information

• Chemical Name: 2-((Dihydro-2(3H)-thienylidene)methyl)-1-methyl-5-nitro-1H-imidazole S,S-dioxide
• CAS No.: 141363-26-0
• Molecular Formula: C9H11 N3 O4 S
• Molecular Weight: 257.29
• Mol file: 141363-26-0.mol

Synonyms:2-((Dihydro-2(3H)-thienylidene)methyl)-1-methyl-5-nitro-1H-imidazole S,S-dioxide;1H-Imidazole, 2-((dihydro-2(3H)-thienylidene)methyl)-1-methyl-5-nitro-, S,S-dioxide;141363-26-0;LS-78487

Chemical Property of 2-((Dihydro-2(3H)-thienylidene)methyl)-1-methyl-5-nitro-1H-imidazole S,S-dioxide

Chemical Property:

• Vapor Pressure: 1.49E-12mmHg at 25°C
• Refractive Index: 1.6320 (estimate)
• Boiling Point: 559.6°Cat760mmHg
• Flash Point: 292.2°C
• PSA: 106.16000
• Density: 1.59g/cm³
• LogP: 2.48180
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 257.04702701
• Heavy Atom Count: 17
• Complexity: 448

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=CN=C1C=C2CCCS2(=O)=O)[N+](=O)[O-]
• Isomeric SMILES: CN1C(=CN=C1/C=C\2/CCCS2(=O)=O)[N+](=O)[O-]