1H-1,2,4-Triazole, 1-[[2-(2,4-difluorophenyl)-2-oxiranyl]methyl]-, methanesulfonate (1:1)

CAS Registry Number®

86386-77-8

CAS Name

1H-1,2,4-Triazole, 1-[[2-(2,4-difluorophenyl)-2-oxiranyl]methyl]-, methanesulfonate (1:1)

Molecular Formula

C11H9F2N3O.CH4O3S

Cite this Page

1H-1,2,4-Triazole, 1-[[2-(2,4-difluorophenyl)-2-oxiranyl]methyl]-, methanesulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=86386-77-8 (retrieved 2024-11-21) (CAS RN: 86386-77-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    192-194 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H9F2N3O.CH4O3S/c12-8-1-2-9(10(13)3-8)11(5-17-11)4-16-7-14-6-15-16;1-5(2,3)4/h1-3,6-7H,4-5H2;1H3,(H,2,3,4)

InChIKey

InChIKey=NJBRNNOGZPVNNR-UHFFFAOYSA-N

SMILES

C(C1(CO1)C2=C(F)C=C(F)C=C2)N3C=NC=N3.S(C)(=O)(=O)O

Canonical SMILES

O=S(=O)(O)C.FC1=CC=C(C(F)=C1)C2(OC2)CN3N=CN=C3

Other Names for this Substance

  • 1H-1,2,4-Triazole, 1-[[2-(2,4-difluorophenyl)-2-oxiranyl]methyl]-, methanesulfonate (1:1)
  • 1H-1,2,4-Triazole, 1-[[2-(2,4-difluorophenyl)oxiranyl]methyl]-, monomethanesulfonate
  • 2-(2,4-Difluorophenyl)-2,3-epoxy-1-(1H-1,2,4-triazol-1-yl)propane methanesulfonate salt
  • 2-(2,4-Difluorophenyl)-2-((1H-1,2,4-triazol-1-yl)methyl)oxirane methanesulfonate

CAS INSIGHTSTM
Targeted protein degrader structure, illustration