methyl (9Z,11E)-13-hydroperoxyoctadeca-9,11-dienoate

Base Information

• Chemical Name: methyl (9Z,11E)-13-hydroperoxyoctadeca-9,11-dienoate
• CAS No.: 27323-65-5
• Molecular Formula: C19H34 O4
• Molecular Weight: 0
• UNII: 13W9041KWU
• DSSTox Substance ID: DTXSID2020842
• Wikidata: Q27251548
• Mol file: 27323-65-5.mol

Synonyms:13-MHPOD;methyl 13-hydroperoxy-9,11-octadecadienoate;methyl 13-hydroperoxy-9,11-octadecadienoate, (E,E)-isomer

Chemical Property of methyl (9Z,11E)-13-hydroperoxyoctadeca-9,11-dienoate

Chemical Property:

• Vapor Pressure: 1E-09mmHg at 25°C
• Boiling Point: 443.4°Cat760mmHg
• Flash Point: 145.1°C
• Density: 0.968g/cm³
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 16
• Exact Mass: 326.24570956
• Heavy Atom Count: 23
• Complexity: 323

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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