Octadecyl 2-methyl-3-(tridecylthio)propionate

Base Information

• Chemical Name: Octadecyl 2-methyl-3-(tridecylthio)propionate
• CAS No.: 36994-36-2
• Molecular Formula: C35H70 O2 S
• Molecular Weight: 554.9941
• European Community (EC) Number: 253-302-1
• DSSTox Substance ID: DTXSID70958165
• Nikkaji Number: J260.715H
• Mol file: 36994-36-2.mol

Synonyms:Octadecyl 2-methyl-3-(tridecylthio)propionate;36994-36-2;EINECS 253-302-1;DTXSID70958165;2-Methyl-3-(tridecylthio)propanoic acid octadecyl ester;OCTADECYL 2-METHYL-3-(TRIDECYLSULFANYL)PROPANOATE

Chemical Property of Octadecyl 2-methyl-3-(tridecylthio)propionate

Chemical Property:

• Vapor Pressure: 8.17E-15mmHg at 25°C
• Boiling Point: 609.8°Cat760mmHg
• Flash Point: 274.6°C
• PSA: 51.60000
• Density: 0.889g/cm³
• LogP: 12.47140
• XLogP3: 16.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 33
• Exact Mass: 554.50965264
• Heavy Atom Count: 38
• Complexity: 453

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCOC(=O)C(C)CSCCCCCCCCCCCCC

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