4-Cyclohexyl-3,3-dimethylbutan-2-one

Base Information

• Chemical Name: 4-Cyclohexyl-3,3-dimethylbutan-2-one
• CAS No.: 93963-12-3
• Molecular Formula: C₁₂H₂₂O
• Molecular Weight: 182.306
• European Community (EC) Number: 300-752-2
• DSSTox Substance ID: DTXSID20239956
• Nikkaji Number: J349.543D
• Wikidata: Q83122537
• Mol file: 93963-12-3.mol

Synonyms:4-Cyclohexyl-3,3-dimethylbutan-2-one;EINECS 300-752-2;93963-12-3;DTXSID20239956

Chemical Property of 4-Cyclohexyl-3,3-dimethylbutan-2-one

Chemical Property:

• Vapor Pressure: 0.0941mmHg at 25°C
• Boiling Point: 223.9°Cat760mmHg
• Flash Point: 72.7°C
• PSA: 17.07000
• Density: 0.879g/cm³
• LogP: 3.57200
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 182.167065321
• Heavy Atom Count: 13
• Complexity: 176

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C(C)(C)CC1CCCCC1