Methyl 5-Chloro-2-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]Triazole-4-Carboxylate
[CAS# 106824-96-8]

Identification

• Name: Methyl 5-Chloro-2-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]Triazole-4-Carboxylate
• Synonyms: Methyl 5-Chloro-2-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]Triazole-4-Carboxylate; 5-Chloro-2-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-4-Triazolecarboxylic Acid Methyl Ester; 5-Chloro-2-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl]Triazole-4-Carboxylic Acid Methyl Ester
• Molecular Formula: C₉H₁₂ClN₃O₆
• Molecular Weight: 293.66
• CAS Registry Number: 106824-96-8
• SMILES: [C@@H]2([N]1N=C(C(=N1)C(=O)OC)Cl)O[C@@H]([C@H]([C@H]2O)O)CO
• InChI: 1S/C9H12ClN3O6/c1-18-9(17)4-7(10)12-13(11-4)8-6(16)5(15)3(2-14)19-8/h3,5-6,8,14-16H,2H2,1H3/t3-,5-,6-,8-/m1/s1
• InChIKey: GRCBSILURPLTRU-ZIYNGMLESA-N

Properties

• Density: 1.941g/cm³ (Cal.)
• Boiling point: 576.764°C at 760 mmHg (Cal.)
• Flash point: 302.616°C (Cal.)