CAS: 241479-74-3 - Isavuconazole intermediate 7

Formula: C₁₃H₁₂F₂N₄O

InChI: InChI=1S/C13H12F2N4O/c1-9(5-16)13(20,6-19-8-17-7-18-19)11-4-10(14)2-3-12(11)15/h2-4,7-9,20H,6H2,1H3/t9-,13+/m0/s1

InChI key: InChIKey=SYSUFNUKZJVPBI-TVQRCGJNSA-N

SMILES: N#CC(C)C(O)(C1=CC(F)=CC=C1F)CN2N=CN=C2

Synonyms:

• (2R,3R)-3-(2,5-Difluorophenyl)-3-Hydroxy-2-Methyl-4-(1H-1,2,4-Triazol-1-Yl))Butanenitrile
• (2S,3R)-3-(2,5-difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanenitrile
• (Alphas,Betar)-Beta-(2,5-Difluorophenyl)-Beta-Hydroxy-Alpha-Methyl-1H-1,2,4-Triazole-1-Butanenitrile
• (αS,βR)-β-(2,5-Difluorophenyl)-β-hydroxy-α-methyl-1H-1,2,4-triazole-1-butanenitrile
• 1H-1,2,4-Triazole-1-butanenitrile, β-(2,5-difluorophenyl)-β-hydroxy-α-methyl-, (αS,βR)-

(αS,βR)-β-(2,5-Difluorophenyl)-β-hydroxy-α-methyl-1H-1,2,4-triazole-1-butanenitrile

CAS: 241479-74-3

• Formula: C₁₃H₁₂F₂N₄O
• Purity: 95%
• Color and Shape: Solid
• Molecular weight: 278.2574

(2S,3R)-3-(2,5-Difluorophenyl)-3-hydroxy-2-methyl-4-(1H-1,2,4-triazol-1-yl)butanenitrile

CAS: 241479-74-3

• Purity: 98%
• Molecular weight: 278.26300048828125

Isavuconazole Impurity 64

CAS: 241479-74-3

• Formula: C₁₃H₁₂F₂N₄O
• Molecular weight: 278.26

(2S,3R)-3-(2,5-DIFLUOROPHENYL)-3-HYDROXY-2-METHYL-4-(1H-1,2,4-TRIAZOL-1-YL)BUTANOIC ACID

CAS: 241479-74-3

• Purity: 97.0%
• Molecular weight: 297.2619934082031

(AlphaS,BetaR)-β-(2,5-Difluorophenyl)-β-hydroxy-α-methyl-1H-1,2,4-triazole-1-butanenitrile

CAS: 241479-74-3

• Formula: C₁₃H₁₂F₂N₄O
• Color and Shape: Neat
• Molecular weight: 278.26

(alphaS,betaR)-β-(2,5-Difluorophenyl)-β-hydroxy-α-methyl-1H-1,2,4-triazole-1-butanenitrile

CAS: 241479-74-3

Intermediate in the synthesis of isavuconazonium

• Formula: C₁₃H₁₂F₂N₄O
• Purity: Min. 95%
• Molecular weight: 278.26 g/mol