14-Methylhexadecanoic acid

Base Information

• Chemical Name: 14-Methylhexadecanoic acid
• CAS No.: 5918-29-6
• Molecular Formula: C₁₇H₃₄O₂
• Molecular Weight: 270.456
• Hs Code.: 2915900090
• European Community (EC) Number: 637-371-9
• DSSTox Substance ID: DTXSID60974612
• Nikkaji Number: J426.815F
• Wikidata: Q27158141
• Metabolomics Workbench ID: 82
• Mol file: 5918-29-6.mol

Synonyms:14-methylhexadecanoic acid;14-methylhexadecanoic acid, (+-)-isomer;14-methylpalmitic acid

Chemical Property of 14-Methylhexadecanoic acid

Chemical Property:

• Vapor Pressure: 4.94E-07mmHg at 25°C
• Melting Point: 36.8 °C
• Refractive Index: 1.4405 (estimate)
• Boiling Point: 386.1°C at 760 mmHg
• PKA: 4.78±0.10(Predicted)
• Flash Point: 216.6°C
• PSA: 37.30000
• Density: 0.889g/cm³
• LogP: 5.79830
• Storage Temp.: 2-8°C
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 14
• Exact Mass: 270.255880323
• Heavy Atom Count: 19
• Complexity: 201

Purity/Quality:

98%,99%, ^*data from raw suppliers

14-Methylhexadecanoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCC(C)CCCCCCCCCCCCC(=O)O
• Description: 14-methyl Palmitic acid is a methylated fatty acid that has been found in bacteria, bovine milk fat, Aegean jellyfish (A. aurita), and one-humped camel (C. dromedarius) meat and fat. It is also found in human breast milk and levels are decreased in mature breast milk compared to colostrum. 14-methyl Palmitic acid is produced in Florida manatee (T. manatus latirostris) liver in response to brevetoxin exposure. [Matreya, LLC. Catalog No. 1616]