(3R,4S,5S,6R)-3,4,5,6-Tetrahydroxyoxepan-2-One
[CAS# 2426-46-2]

Identification

• Name: (3R,4S,5S,6R)-3,4,5,6-Tetrahydroxyoxepan-2-One
• Synonyms: (3R,4S,5S,6R)-3,4,5,6-Tetrahydroxy-2-Oxepanone; Galactonic Acid, Gamma-Lactone; Galactonolactone
• Molecular Formula: C₆H₁₀O₆
• Molecular Weight: 178.14
• CAS Registry Number: 2426-46-2
• SMILES: [C@@H]1(O)[C@@H](O)C(OC[C@@H](O)[C@@H]1O)=O
• InChI: 1S/C6H10O6/c7-2-1-12-6(11)5(10)4(9)3(2)8/h2-5,7-10H,1H2/t2-,3+,4+,5-/m1/s1
• InChIKey: WTXGYGWMPUGBAL-MGCNEYSASA-N

Properties

• Density: 1.787g/cm³ (Cal.)
• Boiling point: 405.385°C at 760 mmHg (Cal.)
• Flash point: 174.266°C (Cal.)