2,9-Dimethyl-2,8-decadiene-4,7-dione

Base Information

• Chemical Name: 2,9-Dimethyl-2,8-decadiene-4,7-dione
• CAS No.: 56079-43-7
• Molecular Formula: C12H18O2
• Molecular Weight: 194.27000
• DSSTox Substance ID: DTXSID50448034
• Nikkaji Number: J501.461A
• Mol file: 56079-43-7.mol

Synonyms:2,9-dimethyl-2,8-decadiene-4,7-dione;56079-43-7;2,8-Decadiene-4,7-dione, 2,9-dimethyl-;SCHEMBL13039627;DTXSID50448034;2,9-dimethyl-deca-2,8-dien-4,7-dione;2,9-dimethyl-deca-2,8-diene-4,7-dione

Chemical Property of 2,9-Dimethyl-2,8-decadiene-4,7-dione

Chemical Property:

• Melting Point: 38-39 °C(Solv: hexane (110-54-3))
• Boiling Point: 95 °C(Press: 0.3 Torr)
• PSA: 34.14000
• Density: 0.935±0.06 g/cm3(Predicted)
• LogP: 2.83720
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 194.130679813
• Heavy Atom Count: 14
• Complexity: 245

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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