Hepta-1,6-dien-3-one

Base Information

• Chemical Name: Hepta-1,6-dien-3-one
• CAS No.: 33698-60-1
• Molecular Formula: C7H10O
• Molecular Weight: 110.156
• DSSTox Substance ID: DTXSID50558263
• Wikidata: Q82440494
• Mol file: 33698-60-1.mol

Synonyms:hepta-1,6-dien-3-one;33698-60-1;SCHEMBL3910058;DTXSID50558263

Chemical Property of Hepta-1,6-dien-3-one

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 110.073164938
• Heavy Atom Count: 8
• Complexity: 103

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C=CCCC(=O)C=C