2,4-Heptadecanedione

Base Information

• Chemical Name: 2,4-Heptadecanedione
• CAS No.: 64042-18-8
• Molecular Formula: C₁₇H₃₂O₂
• Molecular Weight: 268.44
• DSSTox Substance ID: DTXSID4073590
• Nikkaji Number: J581.644K
• Wikidata: Q82002045
• Metabolomics Workbench ID: 49188

Synonyms:2,4-Heptadecanedione;Heptadecane-2,4-dione;64042-18-8;2,4-Heptadecadione;Myristoylacetone;Tetradecanoylacetone;2,4-Heptadecanedione #;SCHEMBL6295743;DTXSID4073590;CHEBI:171737

Chemical Property of 2,4-Heptadecanedione

Chemical Property:

• Vapor Pressure: 1.9E-05mmHg at 25°C
• Boiling Point: 362.7°Cat760mmHg
• Flash Point: 136.1°C
• Density: 0.884g/cm³
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 14
• Exact Mass: 268.240230259
• Heavy Atom Count: 19
• Complexity: 233

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

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