Lesquerolic acid

Base Information

• Chemical Name: Lesquerolic acid
• CAS No.: 4103-20-2
• Molecular Formula: C20H38O3
• Molecular Weight: 326.5139
• UNII: 87K5QW62TR
• DSSTox Substance ID: DTXSID101029878
• Wikipedia: Lesquerolic_acid
• Wikidata: Q6531411
• Metabolomics Workbench ID: 1441
• Mol file: 4103-20-2.mol

Synonyms:lesquerolic acid

Chemical Property of Lesquerolic acid

Chemical Property:

• Vapor Pressure: 9.56E-11mmHg at 25°C
• Boiling Point: 468.5°Cat760mmHg
• Flash Point: 251.3°C
• PSA: 57.53000
• Density: 0.946g/cm³
• LogP: 5.85950
• XLogP3: 6.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 17
• Exact Mass: 326.28209507
• Heavy Atom Count: 23
• Complexity: 287

Purity/Quality:

LESQUEROLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(CC=CCCCCCCCCCC(=O)O)O
• Isomeric SMILES: CCCCCC[C@H](C/C=C\CCCCCCCCCC(=O)O)O