2-Methyl-2-nitrocyclohexanone O-((methylamino)carbonyl)oxime

Base Information

• Chemical Name: 2-Methyl-2-nitrocyclohexanone O-((methylamino)carbonyl)oxime
• CAS No.: 20417-85-0
• Molecular Formula: C9H15N3O4
• Molecular Weight: 229.2331
• DSSTox Substance ID: DTXSID201031309
• Mol file: 20417-85-0.mol

Synonyms:Union carbide UC-23746;ENT 27,304;UC-23746;2-Methyl-2-nitrocyclohexanone O-((methylamino)carbonyl)oxime;Cyclohexanone, 2-methyl-2-nitro-, O-(methylcarbamoyl)oxime;20417-85-0;DTXSID201031309;LS-57337

Chemical Property of 2-Methyl-2-nitrocyclohexanone O-((methylamino)carbonyl)oxime

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 100.00000
• Density: 1.33g/cm³
• LogP: 2.03540
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 229.10625597
• Heavy Atom Count: 16
• Complexity: 323

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CCCCC1=NOC(=O)NC)[N+](=O)[O-]
• Isomeric SMILES: CC\1(CCCC/C1=N\OC(=O)NC)[N+](=O)[O-]

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