6,8,8-Trimethylnona-2,5-dien-4-one

Base Information

• Chemical Name: 6,8,8-Trimethylnona-2,5-dien-4-one
• CAS No.: 96097-18-6
• Molecular Formula: C12H20 O
• Molecular Weight: 180.2866
• European Community (EC) Number: 306-097-9
• Nikkaji Number: J382.881F
• Mol file: 96097-18-6.mol

Synonyms:6,8,8-Trimethylnona-2,5-dien-4-one;EINECS 306-097-9;96097-18-6;6,8,8-Trimethyl-2,5-nonadien-4-one;2,5-Nonadien-4-one, 6,8,8-trimethyl-

Chemical Property of 6,8,8-Trimethylnona-2,5-dien-4-one

Chemical Property:

• Vapor Pressure: 0.025mmHg at 25°C
• Boiling Point: 247.9°Cat760mmHg
• Flash Point: 94.9°C
• PSA: 17.07000
• Density: 0.855g/cm³
• LogP: 3.51410
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 180.151415257
• Heavy Atom Count: 13
• Complexity: 226

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC=CC(=O)C=C(C)CC(C)(C)C
• Isomeric SMILES: C/C=C/C(=O)/C=C(\C)/CC(C)(C)C