Isonitrosoacetone

Base Information

• Chemical Name: Isonitrosoacetone
• CAS No.: 17280-41-0
• Molecular Formula: C3H5NO2
• Molecular Weight: 87.0782
• European Community (EC) Number: 206-184-0,628-911-4
• UNII: U32V8CLT4W
• DSSTox Substance ID: DTXSID0073162
• Nikkaji Number: J1.498.169A
• Wikidata: Q76324797
• ChEMBL ID: CHEMBL17940
• Mol file: 17280-41-0.mol

Synonyms:2-oxopropanal-1-oxime;2-oxopropanaloxime;OXOX

Chemical Property of Isonitrosoacetone

Chemical Property:

• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 87.032028402
• Heavy Atom Count: 6
• Complexity: 76.9

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Oximes
• Canonical SMILES: CC(=O)C=NO
• Isomeric SMILES: CC(=O)/C=N/O