alpha-D-Isosaccharinic Acid
[CAS# 1518-54-3]

Identification

• Name: alpha-D-Isosaccharinic Acid
• Synonyms: 2,4,5-Trihydroxy-2-Methylol-Valeric Acid; Beta-Glucoisosaccharinic Acid; 3-Deoxy-2-C-(Hydroxymethyl)-D-Erythro-Pentonic Acid
• Molecular Formula: C₆H₁₂O₆
• Molecular Weight: 180.16
• CAS Registry Number: 1518-54-3 (1518-56-5)
• SMILES: C(C(C(=O)O)(O)CO)C(O)CO
• InChI: 1S/C6H12O6/c7-2-4(9)1-6(12,3-8)5(10)11/h4,7-9,12H,1-3H2,(H,10,11)
• InChIKey: SGOVJIDEXZEOTB-UHFFFAOYSA-N

Properties

• Density: 1.599g/cm³ (Cal.)
• Boiling point: 583.849°C at 760 mmHg (Cal.)
• Flash point: 320.939°C (Cal.)