1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester

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1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester Basic information
Product Name:1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester
Synonyms:DIMETHYL 2-THIOXO-1,3-DITHIOLE-4,5-DICARBOXYLATE;DIMETHYL 1,3-DITHIOLE-2-THIONE-4,5-DICARBOXYLATE;2-Thioxo-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester;Dimethyl 2-Thioxo-1,3-dithiole-4,5-dicarboxylate 1,3-Dithiole-2-thione-4,5-dicarboxylic Acid Dimethyl Ester;Dimethyl1,3-Dithiole-2-thione-4,5-dicarboxylate>;1,3-Dithiole-4,5-dicarboxylic acid, 2-thioxo-, 4,5-dimethyl ester;Dimethyl 1,3-dithiol-2-thione-4,5-dicarboxylate;2-Thioxo-1,3-dithiole-4,5-dicarboxylic acid
CAS:7396-41-0
MF:C7H6O4S3
MW:250.32
EINECS:
Product Categories:Charge Transfer Complexes (Synthetic Intermediates);Charge Transfer Complexes for Organic Metals;Functional Materials;Heterocyclic Building Blocks;Others;S-Containing;Building Blocks;Chemical Synthesis;Heterocyclic Building Blocks
Mol File:7396-41-0.mol
1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester Structure
1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester Chemical Properties
Melting point 86-90 °C (lit.)
Boiling point 362.5±52.0 °C(Predicted)
density 1.57±0.1 g/cm3(Predicted)
solubility almost transparency in hot Methanol
form powder to crystal
color Light yellow to Brown
BRN 1288368
InChI1S/C7H6O4S3/c1-10-5(8)3-4(6(9)11-2)14-7(12)13-3/h1-2H3
InChIKeyUZKKFHMMXWDIPD-UHFFFAOYSA-N
SMILESCOC(=O)C1=C(SC(=S)S1)C(=O)OC
Safety Information
WGK Germany 3
8-10-23
HS Code 2934.99.4400
Storage Class11 - Combustible Solids
MSDS Information
ProviderLanguage
SigmaAldrich English
1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester Usage And Synthesis
UsesDimethyl 2-thioxo-1,3-dithiole-4,5-dicarboxylate is a sulphur-containing heterocyclic building block. It has been reported to be formed during the reaction of 1,3-dithiolan-2-thiones with dimethyl acetylenedicarboxylate. It is formed as major product during the reaction of ethylene trithiocarbonate with dimethyl acetylenedicarboxylate.
DefinitionChEBI: 2-sulfanylidene-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester is a heteroarene.
Synthesis Reference(s)The Journal of Organic Chemistry, 47, p. 4000, 1982 DOI: 10.1021/jo00141a044
General DescriptionDimethyl 2-thioxo-1,3-dithiole-4,5-dicarboxylate is a sulphur-containing heterocyclic building block. It has been reported to be formed during the reaction of 1,3-dithiolan-2-thiones with dimethyl acetylenedicarboxylate. It is formed as major product during the reaction of ethylene trithiocarbonate with dimethyl acetylenedicarboxylate.
1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester Preparation Products And Raw materials
Raw materialsEthylene trithiocarbonate-->Dimethyl acetylenedicarboxylate
Tag:1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester(7396-41-0) Related Product Information
Methylenebis(thioacetic acid) Bis(carboxymethyl) trithiocarbonate 1,3-Dithiole-2-thione Methyl 2-([[(2-methoxy-2-oxoethyl)thio]methyl]thio)acetate 1,3-Dithiole-2-thione-4,5-dicarboxylic acid dimethyl ester 3,5-Dithia-1,7-heptanediol Dimethyl trithiocarbonate diethyl trithiocarbonate