(2R,3R)-2-(2,4-Difluorophenyl)-3-Sulfanyl-1-(1,2,4-Triazol-1-Yl)Butan-2-Ol
[CAS# 135272-34-3]

Identification

• Name: (2R,3R)-2-(2,4-Difluorophenyl)-3-Sulfanyl-1-(1,2,4-Triazol-1-Yl)Butan-2-Ol
• Synonyms: (2R,3R)-2-(2,4-Difluorophenyl)-3-Mercapto-1-(1,2,4-Triazol-1-Yl)Butan-2-Ol; Dfpmtb; 2-(2,4-Difluorophenyl)-3-Mercapto-1-(1H-1,2,4-Triazol-1-Yl)-2-Butanol
• Molecular Formula: C₁₂H₁₃F₂N₃OS
• Molecular Weight: 285.31
• CAS Registry Number: 135272-34-3
• SMILES: [C@@](C1=CC=C(C=C1F)F)(C[N]2C=NC=N2)([C@@H](C)S)O
• InChI: 1S/C12H13F2N3OS/c1-8(19)12(18,5-17-7-15-6-16-17)10-3-2-9(13)4-11(10)14/h2-4,6-8,18-19H,5H2,1H3/t8-,12-/m1/s1
• InChIKey: XAIWELGWMZINMU-PRHODGIISA-N

Properties

• Density: 1.39g/cm³ (Cal.)
• Boiling point: 451.75°C at 760 mmHg (Cal.)
• Flash point: 227.01°C (Cal.)