2-Mercaptoethyl linoleate

Base Information

• Chemical Name: 2-Mercaptoethyl linoleate
• CAS No.: 52147-29-2
• Molecular Formula: C20H36 O2 S
• Molecular Weight: 340.56364
• European Community (EC) Number: 257-690-3
• DSSTox Substance ID: DTXSID2029373
• Wikidata: Q76386400
• Mol file: 52147-29-2.mol

Synonyms:2-Mercaptoethyl linoleate;52147-29-2;2-Mercaptoethyl (9Z,12Z)-octadeca-9,12-dienoate;EINECS 257-690-3;9,12-Octadecadienoic acid (9Z,12Z)-, 2-mercaptoethyl ester;9,12-Octadecadienoic acid (Z,Z)-, 2-mercaptoethyl ester;SCHEMBL5993877;DTXSID2029373;C20H36O2S;C20-H36-O2-S;2-Mercaptoethyl(9Z,12Z)-octadeca-9,12-dienoate

Chemical Property of 2-Mercaptoethyl linoleate

Chemical Property:

• Vapor Pressure: 7.6E-08mmHg at 25°C
• Boiling Point: 437.2°Cat760mmHg
• Flash Point: 283.8°C
• PSA: 65.10000
• Density: 0.937g/cm³
• LogP: 6.27290
• XLogP3: 7.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 17
• Exact Mass: 340.24360156
• Heavy Atom Count: 23
• Complexity: 311

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC=CCC=CCCCCCCCC(=O)OCCS
• Isomeric SMILES: CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCCS

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