Isopropyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate

Base Information

• Chemical Name: Isopropyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate
• CAS No.: 83918-59-6
• Molecular Formula: C21H36 O2
• Molecular Weight: 320.50934
• European Community (EC) Number: 281-293-4
• DSSTox Substance ID: DTXSID301315235
• Mol file: 83918-59-6.mol

Synonyms:83918-59-6;isopropyl linolenate;EINECS 281-293-4;Isopropyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate;i-Propyl alpha.-linolenate;SCHEMBL1496221;DTXSID301315235;i-Propyl 9,12,15-octadecatrienoate;NS00060936

Chemical Property of Isopropyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate

Chemical Property:

• Vapor Pressure: 1.22E-06mmHg at 25°C
• Boiling Point: 401°C at 760 mmHg
• Flash Point: 97.2°C
• PSA: 26.30000
• Density: 0.89g/cm³
• LogP: 6.52750
• XLogP3: 7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 320.271530387
• Heavy Atom Count: 23
• Complexity: 351

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC=CCC=CCC=CCCCCCCCC(=O)OC(C)C
• Isomeric SMILES: CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC(C)C