1-[[(2S,4R)-2-(2,4-Difluorophenyl)-4-[3-(p-Tolylsulfonyl)Propyl]-1,3-Dioxolan-2-Yl]Methyl]-1,2,4-Triazole
[CAS# 171764-49-1]

Identification

• Name: 1-[[(2S,4R)-2-(2,4-Difluorophenyl)-4-[3-(p-Tolylsulfonyl)Propyl]-1,3-Dioxolan-2-Yl]Methyl]-1,2,4-Triazole
• Synonyms: (2R,4R) cis-(2,4-Difluorophenyl)-2-(1,2,4-triazole-1-yl-methyl)-1,3-dioxolane-4yl-methyl-p-tolysulfonate
• Molecular Formula: C₂₂H₂₃F₂N₃O₄S
• Molecular Weight: 463.50
• CAS Registry Number: 171764-49-1
• SMILES: Cc1ccc(cc1)S(=O)(=O)CCC[C@@H]2CO[C@@](O2)(Cn3cncn3)c4ccc(cc4F)F
• InChI: 1S/C22H23F2N3O4S/c1-16-4-7-19(8-5-16)32(28,29)10-2-3-18-12-30-22(31-18,13-27-15-25-14-26-27)20-9-6-17(23)11-21(20)24/h4-9,11,14-15,18H,2-3,10,12-13H2,1H3/t18-,22-/m1/s1
• InChIKey: FJHPJVUKWPQRTP-XMSQKQJNSA-N

Properties

• Density: 1.379g/cm³ (Cal.)
• Boiling point: 638.1°C at 760 mmHg (Cal.)
• Flash point: 339.711°C (Cal.)
• Refractive index: 1.609 (Cal.)