3,5-Diethyl-2,6-dimethylcyclohex-2-en-1-one

Base Information

• Chemical Name: 3,5-Diethyl-2,6-dimethylcyclohex-2-en-1-one
• CAS No.: 65416-17-3
• Molecular Formula: C12H20 O
• Molecular Weight: 180.2866
• European Community (EC) Number: 265-758-9
• DSSTox Substance ID: DTXSID90867149
• Nikkaji Number: J307.403J
• Mol file: 65416-17-3.mol

Synonyms:3,5-Diethyl-2,6-dimethylcyclohex-2-en-1-one;65416-17-3;2-Cyclohexen-1-one, 3,5-diethyl-2,6-dimethyl-;EINECS 265-758-9;SCHEMBL20608583;DTXSID90867149;1,3-Diethyl-4,6-dimethyl-6-cyclohexen-5-one;3,5-Diethyl-2,6-dimethyl-2-cyclohexen-1-one

Chemical Property of 3,5-Diethyl-2,6-dimethylcyclohex-2-en-1-one

Chemical Property:

• Vapor Pressure: 0.0142mmHg at 25°C
• Boiling Point: 257.9°C at 760 mmHg
• Flash Point: 111.3°C
• PSA: 17.07000
• Density: 0.869g/cm³
• LogP: 3.34800
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 180.151415257
• Heavy Atom Count: 13
• Complexity: 238

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC1CC(=C(C(=O)C1C)C)CC