3-Nitroazepan-2-one

Base Information

• Chemical Name: 3-Nitroazepan-2-one
• CAS No.: 6804-88-2
• Molecular Formula: C6H10N2O3
• Molecular Weight: 158.157
• DSSTox Substance ID: DTXSID40513548
• Mol file: 6804-88-2.mol

Synonyms:3-Nitroazepan-2-one;nitrocaprolactam;6804-88-2;SCHEMBL9637920;DTXSID40513548

Chemical Property of 3-Nitroazepan-2-one

Chemical Property:

• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 158.06914219
• Heavy Atom Count: 11
• Complexity: 175

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCNC(=O)C(C1)[N+](=O)[O-]