3-O-Acetyl-1,5-Anhydro-2,4-Dideoxy-1-Ethyl-2,5-Dimethyl-1-Thiopentitol
[CAS# 462065-53-8]

Identification

• Name: 3-O-Acetyl-1,5-Anhydro-2,4-Dideoxy-1-Ethyl-2,5-Dimethyl-1-Thiopentitol
• Synonyms: 2-ethyl-3,6-dimethyltetrahydro-2H-thiopyran-4-yl acetate; 3-O-acetyl-1,5-anhydro-2,4-dideoxy-1-ethyl-2,5-dimethyl-1-thiopentitol
• Molecular Formula: C₁₁H₂₀O₂S
• Molecular Weight: 216.34
• CAS Registry Number: 462065-53-8
• SMILES: O=C(OC1CC(SC(CC)C1C)C)C
• InChI: 1S/C11H20O2S/c1-5-11-8(3)10(13-9(4)12)6-7(2)14-11/h7-8,10-11H,5-6H2,1-4H3
• InChIKey: JWSCWDYIUHOXAJ-UHFFFAOYSA-N

Properties

• Density: 1.023g/cm³ (Cal.)
• Boiling point: 276.184°C at 760 mmHg (Cal.)
• Flash point: 115.233°C (Cal.)
• Refractive index: 1.486 (Cal.)