3-Oxo-2-tetradecyloctadecanoic acid

Base Information

• Chemical Name: 3-Oxo-2-tetradecyloctadecanoic acid
• CAS No.: 51048-16-9
• Molecular Formula: C32H62 O3
• Molecular Weight: 494.83
• DSSTox Substance ID: DTXSID50965332
• Mol file: 51048-16-9.mol

Synonyms:3-oxo-2-tetradecyloctadecanoate;3-oxo-2-tetradecyloctadecanoic acid;dehydrocorynomycolic acid

Chemical Property of 3-Oxo-2-tetradecyloctadecanoic acid

Chemical Property:

• Vapor Pressure: 1.91E-15mmHg at 25°C
• Boiling Point: 589.9°Cat760mmHg
• Flash Point: 324.6°C
• PSA: 54.37000
• Density: 0.901g/cm³
• LogP: 10.82880
• XLogP3: 14.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 29
• Exact Mass: 494.46989584
• Heavy Atom Count: 35
• Complexity: 460

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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