4-Amino-3-(trifluoromethyl)phenyl 1,1,1-trifluoromethanesulfonate

CAS Registry Number®

1820740-69-9
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CAS Name

4-Amino-3-(trifluoromethyl)phenyl 1,1,1-trifluoromethanesulfonate

Molecular Formula

C8H5F6NO3S

Molecular Mass

309.19

Cite this Page

4-Amino-3-(trifluoromethyl)phenyl 1,1,1-trifluoromethanesulfonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1820740-69-9 (retrieved 2024-07-01) (CAS RN: 1820740-69-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H5F6NO3S/c9-7(10,11)5-3-4(1-2-6(5)15)18-19(16,17)8(12,13)14/h1-3H,15H2

InChIKey

InChIKey=CVXANEFQUAVFII-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C1=CC(OS(C(F)(F)F)(=O)=O)=CC=C1N

Canonical SMILES

O=S(=O)(OC1=CC=C(N)C(=C1)C(F)(F)F)C(F)(F)F

Other Names for this Substance

  • Methanesulfonic acid, 1,1,1-trifluoro-, 4-amino-3-(trifluoromethyl)phenyl ester
  • 4-Amino-3-(trifluoromethyl)phenyl 1,1,1-trifluoromethanesulfonate