3,6-Dimethyl-3-vinylhept-5-en-2-one

Base Information

• Chemical Name: 3,6-Dimethyl-3-vinylhept-5-en-2-one
• CAS No.: 80192-39-8
• Molecular Formula: C11H18O
• Molecular Weight: 166.26
• European Community (EC) Number: 279-416-1
• DSSTox Substance ID: DTXSID701001094
• Nikkaji Number: J320.240B
• Mol file: 80192-39-8.mol

Synonyms:3,6-Dimethyl-3-vinylhept-5-en-2-one;80192-39-8;EINECS 279-416-1;3-ethenyl-3,6-dimethylhept-5-en-2-one;SCHEMBL11040736;DTXSID701001094;3-Ethenyl-3,6-dimethyl-5-hepten-2-one;5-Hepten-2-one, 3-ethenyl-3,6-dimethyl-

Chemical Property of 3,6-Dimethyl-3-vinylhept-5-en-2-one

Chemical Property:

• Vapor Pressure: 0.0687mmHg at 25°C
• Boiling Point: 229.6°Cat760mmHg
• Flash Point: 78.4°C
• PSA: 17.07000
• Density: 0.849g/cm³
• LogP: 3.12400
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 166.135765193
• Heavy Atom Count: 12
• Complexity: 209

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCC(C)(C=C)C(=O)C)C

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