(1R,2S,3R)-1-(1-Methyl-1H-pyrazol-4-yl)-1,2,3,4-butanetetrol
[CAS# 799260-82-5]

Identification

• Name: (1R,2S,3R)-1-(1-Methyl-1H-pyrazol-4-yl)-1,2,3,4-butanetetrol
• Synonyms: (1R,2S,3R)-1-(1-methyl-1H-pyrazol-4-yl)butane-1,2,3,4-tetraol
• Molecular Formula: C₈H₁₄N₂O₄
• Molecular Weight: 202.21
• CAS Registry Number: 799260-82-5
• SMILES: Cn1cc(cn1)[C@H]([C@@H]([C@@H](CO)O)O)O
• InChI: 1S/C8H14N2O4/c1-10-3-5(2-9-10)7(13)8(14)6(12)4-11/h2-3,6-8,11-14H,4H2,1H3/t6-,7-,8-/m1/s1
• InChIKey: KFUKMKKKBBNUCT-BWZBUEFSSA-N

Properties

• Density: 1.48g/cm³ (Cal.)
• Boiling point: 498.592°C at 760 mmHg (Cal.)
• Flash point: 255.339°C (Cal.)
• Refractive index: 1.606 (Cal.)