3-Oxocyclopent-1-enecarbonitrile

Base Information

• Chemical Name: 3-Oxocyclopent-1-enecarbonitrile
• CAS No.: 34250-16-3
• Molecular Formula: C6H5NO
• Molecular Weight: 107.112
• DSSTox Substance ID: DTXSID50545658
• Nikkaji Number: J2.026.613I
• Wikidata: Q82423228
• Mol file: 34250-16-3.mol

Synonyms:3-Oxocyclopent-1-enecarbonitrile;34250-16-3;3-oxocyclopentene-1-carbonitrile;3-Oxocyclopent-1-ene-1-carbonitrile;SCHEMBL4542080;DTXSID50545658;3-oxo-cyclopentene-1-carbonitrile;3-oxo-1-cyclopentene-1-carbonitrile;AKOS014572500;F18198;EN300-1249497

Chemical Property of 3-Oxocyclopent-1-enecarbonitrile

Chemical Property:

• XLogP3: 0
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 107.037113783
• Heavy Atom Count: 8
• Complexity: 194

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)C=C1C#N