Isotridecyl mercaptoacetate

Base Information

• Chemical Name: Isotridecyl mercaptoacetate
• CAS No.: 57417-85-3
• Molecular Formula: C15H30 O2 S
• Molecular Weight: 274.46
• European Community (EC) Number: 260-730-2
• DSSTox Substance ID: DTXSID90972904
• Wikidata: Q82956739
• Mol file: 57417-85-3.mol

Synonyms:Isotridecyl thioglycolate;Isotridecyl mercaptoacetate;57417-85-3;11-methyldodecyl 2-sulfanylacetate;137754-72-4;Acetic acid, mercapto-, isotridecyl ester;Iso-tridecyl thioglycolate;EINECS 260-730-2;Acetic acid, 2-mercapto-, isotridecyl ester;ACETIC ACID, MERCAPTO-, ISOTRIDECYLESTER;11-methyldodecyl sulfanylacetate;SCHEMBL20483674;DTXSID90972904;11-Methyldodecyl 2-mercaptoacetate;Acetic acid,mercapto-,isotridecylester;ACETICACID,MERCAPTO-,ISOTRIDECYLESTER

Chemical Property of Isotridecyl mercaptoacetate

Chemical Property:

• Vapor Pressure: 3.34E-05mmHg at 25°C
• Boiling Point: 354.5°Cat760mmHg
• Flash Point: 206.3°C
• PSA: 65.10000
• Density: 0.933g/cm³
• LogP: 4.62630
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 13
• Exact Mass: 274.19665137
• Heavy Atom Count: 18
• Complexity: 193

Purity/Quality:

98%Min ^*data from raw suppliers

ISOTRIDECYL MERCAPTO ACETIC ACID ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCCCCCCCCOC(=O)CS

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