1,6-Heptadien-4-one, 2,5,5-trimethyl-

Base Information

• Chemical Name: 1,6-Heptadien-4-one, 2,5,5-trimethyl-
• CAS No.: 512-37-8
• Molecular Formula: C10H16O
• Molecular Weight: 152.236
• DSSTox Substance ID: DTXSID50487201
• Nikkaji Number: J505.512A
• Wikidata: Q82329141
• Mol file: 512-37-8.mol

Synonyms:Artemisiaketon;1,6-Heptadien-4-one, 2,5,5-trimethyl-;512-37-8;DTXSID50487201

Chemical Property of 1,6-Heptadien-4-one, 2,5,5-trimethyl-

Chemical Property:

• Boiling Point: 202.6±9.0 °C(Predicted)
• PSA: 17.07000
• Density: 0.842±0.06 g/cm3(Predicted)
• LogP: 2.73390
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 152.120115130
• Heavy Atom Count: 11
• Complexity: 187

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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