3-Methyl-2-nitro-3H-imidazo[4,5-F]quinoline

Base Information

• Chemical Name: 3-Methyl-2-nitro-3H-imidazo[4,5-F]quinoline
• CAS No.: 114451-08-0
• Molecular Formula: C₁₁H₈N₄O₂
• Molecular Weight: 228.21
• UNII: O8YW0O14FY
• DSSTox Substance ID: DTXSID20150733
• Nikkaji Number: J525.435C
• Wikidata: Q27894315
• Mol file: 114451-08-0.mol

Synonyms:2-nitro-3-methylimidazo(4,5-f)quinoline;IQ(NO2);nitro-IQ

Chemical Property of 3-Methyl-2-nitro-3H-imidazo[4,5-F]quinoline

Chemical Property:

• Vapor Pressure: 4.84E-10mmHg at 25°C
• Melting Point: 277-278掳C
• Boiling Point: 497.7°Cat760mmHg
• PKA: 2.24±0.50(Predicted)
• Flash Point: 254.8°C
• PSA: 76.53000
• Density: 1.53g/cm³
• LogP: 2.55290
• Storage Temp.: Refrigerator
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 228.06472551
• Heavy Atom Count: 17
• Complexity: 319

Purity/Quality:

95% ^*data from raw suppliers

3-Methyl-2-nitro-3H-imidazo[4,5-F]quinoline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C2=C(C3=C(C=C2)N=CC=C3)N=C1[N+](=O)[O-]
• Uses: A mutagenic compound produced by cooking beef.

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