9,12,15-Octadecatrien-6-ynoic acid

Base Information

• Chemical Name: 9,12,15-Octadecatrien-6-ynoic acid
• CAS No.: 61481-30-9
• Molecular Formula: C18H26 O2
• Molecular Weight: 0
• Mol file: 61481-30-9.mol

Synonyms:9,12,15-octadecatrien-6-ynoic acid;dicranin

Chemical Property of 9,12,15-Octadecatrien-6-ynoic acid

Chemical Property:

• Vapor Pressure: 5.06E-08mmHg at 25°C
• Boiling Point: 414.2°C at 760 mmHg
• Flash Point: 198.1°C
• PSA: 37.30000
• Density: 0.964g/cm³
• LogP: 4.88370
• XLogP3: 5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 274.193280068
• Heavy Atom Count: 20
• Complexity: 388

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC=CCC=CCC=CCC#CCCCCC(=O)O
• Isomeric SMILES: CC/C=C/C/C=C/C/C=C/CC#CCCCCC(=O)O