Acetic acid, mercapto-, 2-ethyl-2-[[(mercaptoacetyl)oxy]methyl]-1,3-propanediyl ester

Base Information

• Chemical Name: Acetic acid, mercapto-, 2-ethyl-2-[[(mercaptoacetyl)oxy]methyl]-1,3-propanediyl ester
• CAS No.: 10193-96-1
• Deprecated CAS: 1198094-95-9
• Molecular Formula: C12H20 O6 S3
• Molecular Weight: 443.52
• Hs Code.: 29309090
• European Community (EC) Number: 233-480-7
• NSC Number: 54090
• DSSTox Substance ID: DTXSID3064988
• Nikkaji Number: J227.096J
• Wikidata: Q81991895
• Mol file: 10193-96-1.mol

Synonyms:10193-96-1;Trimethylolpropane Tris(thioglycolate);TMTG;Acetic acid, mercapto-, 2-ethyl-2-[[(mercaptoacetyl)oxy]methyl]-1,3-propanediyl ester;2,2-bis[(2-sulfanylacetyl)oxymethyl]butyl 2-sulfanylacetate;Trimethylolpropane tris(2-mercaptoacetate);Acetic acid, mercapto-, 2-ethyl-2-(((mercaptoacetyl)oxy)methyl)-1,3-propanediyl ester;NSC54090;SCHEMBL60815;DTXSID3064988;trimethylolpropane trithioglycolate;trimethylolpropanetris(thioglycolate);EINECS 233-480-7;MFCD00046836;NSC 54090;NSC-54090;AKOS015912945;1,1,1-Tris(thioglycoloyloxymethyl)propane;FT-0731225;T2633;E75966;J-000526;Trimethylolpropane tris(2-mercaptoacetate), technical grade;2-Ethyl-2-(((mercaptoacetyl)oxy)methyl)-1,3-propanediyl bis(mercaptoacetate);2-ethyl-2-((2-mercaptoacetoxy)methyl)propane-1,3-diyl bis(2-mercaptoacetate);Acetic acid, 2-mercapto-, 1,1'-(2-ethyl-2-(((2-mercaptoacetyl)oxy)methyl)-1,3-propanediyl) ester

Chemical Property of Acetic acid, mercapto-, 2-ethyl-2-[[(mercaptoacetyl)oxy]methyl]-1,3-propanediyl ester

Chemical Property:

• Vapor Pressure: 2.27E-09mmHg at 25°C
• Refractive Index: n20/D 1.529(lit.)
• Boiling Point: 479.9°Cat760mmHg
• PKA: 7.37±0.10(Predicted)
• Flash Point: 384.1°C
• PSA: 195.30000
• Density: 1.276g/cm³
• LogP: 0.80180
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 13
• Exact Mass: 356.04220187
• Heavy Atom Count: 21
• Complexity: 311

Purity/Quality:

99% ^*data from raw suppliers

TrimethylolpropaneTris(2-mercaptoacetate) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 23-26-28-36-37/39-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCC(COC(=O)CS)(COC(=O)CS)COC(=O)CS
• Uses: Curing or cross-linking agent for polymeric systems, especially epoxy resins; intermediate for stabilizers and antioxidants.