(3aS,4S,6aR)-4-(Hydroxymethyl)-3,3A,4,6A-Tetrahydro-6H-Furo[3,4-c]Pyrazol-6-One
[CAS# 176749-50-1]

Identification

• Name: (3aS,4S,6aR)-4-(Hydroxymethyl)-3,3A,4,6A-Tetrahydro-6H-Furo[3,4-c]Pyrazol-6-One
• Synonyms: (3aS,4S,6aR)-4-(hydroxymethyl)-3a,4-dihydro-3H-furo[3,4-c]pyrazol-6(6aH)-one
• Molecular Formula: C₆H₈N₂O₃
• Molecular Weight: 156.14
• CAS Registry Number: 176749-50-1
• SMILES: C1[C@@H]2[C@H](OC(=O)[C@@H]2N=N1)CO
• InChI: 1S/C6H8N2O3/c9-2-4-3-1-7-8-5(3)6(10)11-4/h3-5,9H,1-2H2/t3-,4-,5-/m1/s1
• InChIKey: CLMXQMMKEBFJHD-UOWFLXDJSA-N

Properties

• Density: 1.893g/cm³ (Cal.)
• Boiling point: 375.4°C at 760 mmHg (Cal.)
• Flash point: 180.836°C (Cal.)
• Refractive index: 1.771 (Cal.)