3,3-Dimethylhex-5-EN-2-one

Base Information

• Chemical Name: 3,3-Dimethylhex-5-EN-2-one
• CAS No.: 26118-94-5
• Molecular Formula: C8H14O
• Molecular Weight: 126.199
• DSSTox Substance ID: DTXSID00504134
• Nikkaji Number: J47.472J
• Wikidata: Q63391622
• Mol file: 26118-94-5.mol

Synonyms:3,3-DIMETHYLHEX-5-EN-2-ONE;3,3-dimethyl-5-hexen-2-one;4,4-dimethylhex-1-en-5-one;26118-94-5;4,4-dimethyl-1-hexen-5-one;SCHEMBL9801312;3,3-Dimethyl-hex-5-en-2-one;DTXSID00504134;AICKKCPBGSMRJG-UHFFFAOYSA-N;Q63391622

Chemical Property of 3,3-Dimethylhex-5-EN-2-one

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 126.104465066
• Heavy Atom Count: 9
• Complexity: 123

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C(C)(C)CC=C