(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E)-octadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoic acid

Base Information

• Chemical Name: (3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E)-octadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoic acid
• CAS No.: 68937-90-6
• Deprecated CAS: 58449-70-0
• Molecular Formula: C54H56O6
• Molecular Weight: 801.01884
• European Community (EC) Number: 500-239-5
• Wikidata: Q76386486
• Mol file: 68937-90-6.mol

Synonyms:Trimer acid;68937-90-6;EC 500-239-5;(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E)-octadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoic acid;SCHEMBL4212865;CFQZKFWQLAHGSL-FNTYJUCDSA-N;500-239-5 (NLP #)

Chemical Property of (3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(3E,5E,7E,9E,11E,13E,15E)-octadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoyl]oxyoctadeca-3,5,7,9,11,13,15,17-octaenoic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 967°C at 760 mmHg
• Flash Point: 273.4°C
• PSA: 89.90000
• Density: 1.04g/cm³
• LogP: 13.22130
• XLogP3: 14.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 31
• Exact Mass: 800.40768950
• Heavy Atom Count: 60
• Complexity: 1940

Purity/Quality:

99.9% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: UVCB
• Canonical SMILES: C=CC=CC=CC=CC=CC=CC=CC=CCC(=O)OC=CC=CC=CC=CC=CC=CC=CC=CCC(=O)OC=CC=CC=CC=CC=CC=CC=CC=CCC(=O)O
• Isomeric SMILES: C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/CC(=O)O/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/CC(=O)O/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/CC(=O)O