Methyl (2S,3S,4S,5R,6S)-3,4,5-Triacetoxy-6-Phenylsulfanyl-Tetrahydropyran-2-Carboxylate
[CAS# 62812-42-4]

Identification

• Name: Methyl (2S,3S,4S,5R,6S)-3,4,5-Triacetoxy-6-Phenylsulfanyl-Tetrahydropyran-2-Carboxylate
• Synonyms: b-D-Glucopyranosiduronic acid methyl ester, phenyl 1-thio-, 2,3,4-triacetate; β-D-Glucopyranosiduronic acid, phenyl 1-thio-, Methyl ester, triacetate
• Molecular Formula: C₁₉H₂₂O₉S
• Molecular Weight: 426.44
• CAS Registry Number: 62812-42-4
• SMILES: CC(=O)O[C@H]1[C@@H]([C@H](O[C@H]([C@@H]1OC(=O)C)Sc2ccccc2)C(=O)OC)OC(=O)C
• InChI: 1S/C19H22O9S/c1-10(20)25-14-15(26-11(2)21)17(27-12(3)22)19(28-16(14)18(23)24-4)29-13-8-6-5-7-9-13/h5-9,14-17,19H,1-4H3/t14-,15-,16-,17+,19-/m0/s1
• InChIKey: AXUXNCRKZCBMKR-CWLGOENISA-N

Properties

• Density: 1.336g/cm³ (Cal.)
• Boiling point: 494.289°C at 760 mmHg (Cal.)
• Flash point: 236.669°C (Cal.)