3-(4-Nitro-1H-imidazol-1-yl)cyclobutanone

Base Information

• Chemical Name: 3-(4-Nitro-1H-imidazol-1-yl)cyclobutanone
• CAS No.: 716316-22-2
• Molecular Formula: C₇H₇N₃O₃
• Molecular Weight: 181.151
• Hs Code.: 2933290090
• DSSTox Substance ID: DTXSID90466090
• Nikkaji Number: J2.057.411I
• Wikidata: Q82292508
• Mol file: 716316-22-2.mol

Synonyms:3-(4-Nitro-1H-imidazol-1-yl)cyclobutanone;716316-22-2;3-(4-nitroimidazol-1-yl)cyclobutan-1-one;DTXSID90466090;FT-0686291;3-(4-Nitro-1H-imidazol-1-yl)cyclobutan-1-one

Chemical Property of 3-(4-Nitro-1H-imidazol-1-yl)cyclobutanone

Chemical Property:

• PSA: 80.71000
• LogP: 1.21850
• XLogP3: -1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 181.04874109
• Heavy Atom Count: 13
• Complexity: 242

Purity/Quality:

98%min ^*data from raw suppliers

3-(4-Nitro-1H-imidazol-1-yl)cyclobutanone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1C(CC1=O)N2C=C(N=C2)[N+](=O)[O-]

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