Product Name

  • Name

    ETHYL 2,3,4,6-TETRA-O-ACETYL-1-THIO-BETA-D-GLUCOPYRANOSIDE

  • EINECS 1533716-785-6
  • CAS No. 52645-73-5
  • Article Data57
  • CAS DataBase
  • Density 1.27 g/cm3
  • Solubility
  • Melting Point 78-79 °C
  • Formula C16H24O9S
  • Boiling Point 453.2 °C at 760 mmHg
  • Molecular Weight 392.427
  • Flash Point 212.6 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 52645-73-5 (ETHYL 2,3,4,6-TETRA-O-ACETYL-1-THIO-BETA-D-GLUCOPYRANOSIDE)
  • Hazard Symbols
  • Synonyms ETHYL 2,3,4,6-TETRA-O-ACETYL-1-THIO-BETA-D-GLUCOPYRANOSIDE;ETHYL 2,3,4,6-TETRA-O-ACETYL-B-D-1-THIOGLUCOPYRANOSIDE;ETHYL 2,3,4,6-TETRA-O-ACETYL-BETA-D-THIOGLUCOPYRANOSIDE;ETHYL-2,3,4,6-TETRA-O-ACETYL-BETA-D-1-THIOGLUCOPYRANOSIDE;Ethyl 2,3,4,6-tetra-O-acetyl-1-thio-b-D-glucopyranoside;.beta.-D-Glucopyranoside, ethyl 1-thio-, tetraacetate;ETHYL 2,3,4,6-TETRA-O-ACETYL-SS-D-THIOGLUCOPYRANOSIDE;Ethyl 2,3,4,6-tetra-O-acetyl-alpha-D-thioglucopyranoside
  • PSA 139.73000
  • LogP 0.82260

Ethyl 2,3,4,6-tetra-O-acetyl-alpha-D-thioglucopyranoside Specification

The Ethyl 2,3,4,6-tetra-O-acetyl-alpha-D-thioglucopyranoside, with the CAS registry number 52645-73-5, is also known as Hexopyranoside, ethyl 1-thio-, tetraacetate. This chemical's molecular formula is C16H24O9S and molecular weight is 392.42. Its IUPAC name is called (3,4,5-triacetyloxy-6-ethylsulfanyloxan-2-yl)methyl acetate.

Physical properties of Ethyl 2,3,4,6-tetra-O-acetyl-alpha-D-thioglucopyranoside: (1)ACD/LogP: 2.66; (2)#H bond acceptors: 9; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 11; (5)Index of Refraction: 1.501; (6)Molar Refractivity: 91.15 cm3; (7)Molar Volume: 308.9 cm3; (8)Surface Tension: 46.3 dyne/cm; (9)Density: 1.27 g/cm3; (10)Flash Point: 212.6 °C; (11)Enthalpy of Vaporization: 71.26 kJ/mol; (12)Boiling Point: 453.2 °C at 760 mmHg; (13)Vapour Pressure: 2.11E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCSC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
(2)InChI: InChI=1S/C16H24O9S/c1-6-26-16-15(24-11(5)20)14(23-10(4)19)13(22-9(3)18)12(25-16)7-21-8(2)17/h12-16H,6-7H2,1-5H3
(3)InChIKey: YPNFVZQPWZMHIF-UHFFFAOYSA-N

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