Octa-3,4-dien-2-one

Base Information

• Chemical Name: Octa-3,4-dien-2-one
• CAS No.: 95887-52-8
• Molecular Formula: C8H12 O
• Molecular Weight: 124.18028
• DSSTox Substance ID: DTXSID40537860
• Mol file: 95887-52-8.mol

Synonyms:95887-52-8;Octa-3,4-dien-2-one;DTXSID40537860

Chemical Property of Octa-3,4-dien-2-one

Chemical Property:

• PSA: 17.07000
• LogP: 2.08680
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 124.088815002
• Heavy Atom Count: 9
• Complexity: 139

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC=C=CC(=O)C