13-Hydroxy-9-methoxy-10-oxo-11-octadecenoic acid

Base Information

• Chemical Name: 13-Hydroxy-9-methoxy-10-oxo-11-octadecenoic acid
• CAS No.: 150147-08-3
• Molecular Formula: C19H34 O5
• Molecular Weight: 342.47
• Nikkaji Number: J549.802C
• Metabolomics Workbench ID: 72163
• Mol file: 150147-08-3.mol

Synonyms:13-HMO-18C acid;13-hydroxy-9-methoxy-10-oxo-11-octadecenoic acid

Chemical Property of 13-Hydroxy-9-methoxy-10-oxo-11-octadecenoic acid

Chemical Property:

• Vapor Pressure: 4.75E-12mmHg at 25°C
• Boiling Point: 499°Cat760mmHg
• Flash Point: 167.6°C
• PSA: 83.83000
• Density: 1.031g/cm³
• LogP: 3.88320
• XLogP3: 4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 16
• Exact Mass: 342.24062418
• Heavy Atom Count: 24
• Complexity: 365

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(C=CC(=O)C(CCCCCCCC(=O)O)OC)O
• Isomeric SMILES: CCCCCC(/C=C/C(=O)C(CCCCCCCC(=O)O)OC)O