Methyl thioglycolate

• Catalog Number: ACM2365482
• Product Name: Methyl thioglycolate
• CAS: 2365-48-2
• Category: Heterocyclic Organic Compound
• Synonyms: RP18865; methyl-2-mercaptoacetate; Methyl sulfanylacetate #; mercapto-acetic acid methylester; NSC-75117; 2365-48-2; MCULE-3020830180; Acetic acid, 2-mercapto-, methyl ester; TRA0039347; Thioglykolsaeure-methylester
• IUPAC Name: methyl 2-sulfanylacetate
• Molecular Weight: 106.139g/mol
• Molecular Formula: C3H6O2S
• Canonical SMILES: COC(=O)CS
• InChI: InChI=1S/C3H6O2S/c1-5-3(4)2-6/h6H,2H2,1H3
• InChI Key: MKIJJIMOAABWGF-UHFFFAOYSA-N
• Application: Methyl Thioglycolate is an derivative of Thioglycolic Acid (T350760), an organic compound containing both a thiol and a carboxylic acid functional groups. Thioglycolic Acid and its derivatives are often used in organic synthesis as a nucleophile in thioglycolysis reactions and is also used as a S transfer agent for sulfonyl chloride synthesis. Methyl Thioglycolate have been studied for the its influence on neocarzinostatin activation and expression of DNA damage.
• Storage: Store below +30°C.
• Complexity: 52.8
• Covalently-Bonded Unit Count: 1
• Decomposition: When heated to decomposition it emits toxic fumes of sulfoxides.
• EC Number: 219-121-7
• Exact Mass: 106.009g/mol
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Heavy Atom Count: 6
• Monoisotopic Mass: 106.009g/mol
• NSC Number: 75117
• Rotatable Bond Count: 2
• Topological Polar Surface Area: 27.3A^2
• Undefined Atom Stereocenter Count: 1
• UNII: O1608LA9EL
• Vapor Pressure: 3.00 mmHg