2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose | CAS No. 13639-54-8

2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose

Basic Information

CAS Number

13639-54-8

Molecular Formula

C17H24O10S2

Molecular Weight

452.5 g/mol

AD

Basic Physical Properties

Melting Point

88-890C

CCOC(=S)SC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C17H24O10S2/c1-6-22-17(28)29-16-15(26-11(5)21)14(25-10(4)20)13(24-9(3)19)12(27-16)7-23-8(2)18/h12-16H,6-7H2,1-5H3/t12-,13-,14+,15-,16+/m1/s1

InChIKey

GYORARISFGRNMU-LJIZCISZSA-N

LogP

1.1240999999999999

Topological Polar Surface Area

123.66000000000003 Ų

Hydrogen Bond Donor/Acceptor

0 / 10

Complexity

638

Synonyms & References

English

  • beta-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate 1-(O-ethylcarbonodithioate)
  • 13639-54-8
  • beta.-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate 1-(O-ethyl carbonodithioate)
  • SCHEMBL12611391
  • 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate
  • 1-Thio-beta-D-glucopyranose-2,3,4,6-tetraacetate 1-(O-ethylcarbonodithioate)
  • .BETA..-D-GLUCOPYRANOSE, 1-THIO-, 2,3,4,6-TETRAACETATE 1-(O-ETHYL CARBONODITHIOATE)
  • [(2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-ethoxycarbothioylsulfanyl-tetrahydropyran-2-yl]methyl acetate
  • NSC66060
  • NSC-66060
  • 2,3,4,6-Tetra-O-acetyl- beta -D-glucopyranosyl Ethylxanthate
  • AKOS016006378
  • GLUCOPYRANOSE, 1-THIO-, 2,3,4,6-TETRAACETATE 1-(O-ETHYL DITHIOCARBONATE), .BETA.-D-
  • DTXSID60159780
  • .beta.-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate 1-(O-ethylcarbonodithioate)
  • 1-Thio-beta-D-glucopyranose 2,3,4,6-tetraacetate 1-(o-ethylcarbonodithioate)
  • A-D-glucopyranosyl Ethylxanthate
  • 6B7H7VSR0Q
  • 2,3,4,6-Tetra-O-acetyl-
  • 2,3,4,6-Tetra-O-acetyl-?-D-glucopyranosyl Ethylxanthate
  • NSC 66060
  • UNII-6B7H7VSR0Q
  • beta-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate 1-(O-ethyl carbonodithioate)
  • 1-Thio-beta-D-glucopyranose 2,3,4,6-tetraacetate 1-(O-ethylcarbonodithioate)
  • 2,3,4,6-Tetra-O-acetyl-β-D-glucopyranosyl Ethylxanthate
  • [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl]methyl acetate
  • [3,5-diacetyloxy-2-(acetyloxymethyl)-6-ethoxycarbothioylsulfanyloxan-4-yl]acetate
  • 2,3,4,6-Tetra-O-acet
  • 2,3,4,6-TETRA-O-ACETYL-B-D-GLUCOPYRANOSYL ETHYLXANTHATE
  • 2,3,4,6-TETRA-O-ACETYL-Β-D-GLUCOSE ETHYLXANTHAT
  • Glucopyranose,1-thio-, 2,3,4,6-tetraacetate 1-(O-ethyl dithiocarbonate), b-D- (8CI)

MDL Number

MFCD08457771

FAQ

What are the physical and chemical properties of 2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8)?

2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8) is a white crystalline solid with a molecular weight of approximately 622.6 g/mol. It is slightly soluble in water and ethanol. It exhibits good stability under normal conditions but can react with reducing agents. This compound is used as a reagent in various chemical reactions and as an intermediate in organic synthesis.

How is 2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8) typically synthesized?

2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8) is typically synthesized through a multi-step process involving acetylation of glucopyranose followed by the introduction of the ethoxycarbonothioyl group. This involves the use of acetic anhydride and ethyl bromoacetothioate as reagents, with careful control of reaction conditions to achieve high yields and selectivity.

What industries use 2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8)?

2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8) is primarily used in the pharmaceutical and chemical industries as an intermediate for the synthesis of other compounds. It is also relevant in the development of sensors and materials science due to its unique chemical properties.

What precautions should be taken when handling 2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8)?

When handling 2,3,4,6-Tetra-O-acetyl-1-S-(ethoxycarbonothioyl)-1-thio-beta-D-glucopyranose (CAS: 13639-54-8), it is important to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to avoid inhalation of any vapors. Spills should be cleaned up immediately using appropriate absorbents and proper disposal methods as outlined in the Safety Data Sheet (SDS).

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