1,5-Anhydro-4-Deoxy-4-Methyl-1-Thio-D-Ribitol
[CAS 451478-21-0]

Identification

• Name: 1,5-Anhydro-4-Deoxy-4-Methyl-1-Thio-D-Ribitol
• Synonyms: (3R,4R,5S)-3,4-Dihydroxy-5-methylthiane; (3R,4R,5S)-5-methyltetrahydro-2H-thiopyran-3,4-diol; InChI=1/C6H12O2S/c1-4-2-9-3-5(7)6(4)8/h4-8H,2-3H2,1H3/t4-,5+,6-/m1/s1
• Molecular Formula: C₆H₁₂O₂S
• Molecular Weight: 148.22
• CAS Registry Number: 451478-21-0
• SMILES: C[C@@H]1CSC[C@@H]([C@@H]1O)O
• InChI: 1S/C6H12O2S/c1-4-2-9-3-5(7)6(4)8/h4-8H,2-3H2,1H3/t4-,5+,6-/m1/s1
• InChIKey: KRYKGOWEDDPPOJ-NGJCXOISSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 256.8±40.0°C at 760 mmHg (Cal.)
• Flash point: 125.4±26.0°C (Cal.)
• Refractive index: 1.566 (Cal.)

References

• (1): Víctor Ulgar, José G. Fernández-Bolaños and Mikael Bols. Synthesis and evaluation of sulfonium analogues of isofucofagomine as glycosidase inhibitors, J. Chem. Soc., Perkin Trans. 1, 2002, 0, 1242.