Methyl 3-amino-5-[(trifluoromethyl)thio]benzoate

CAS Registry Number®

1820619-95-1
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CAS Name

Methyl 3-amino-5-[(trifluoromethyl)thio]benzoate

Molecular Formula

C9H8F3NO2S

Molecular Mass

251.23

Cite this Page

Methyl 3-amino-5-[(trifluoromethyl)thio]benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1820619-95-1 (retrieved 2024-08-24) (CAS RN: 1820619-95-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H8F3NO2S/c1-15-8(14)5-2-6(13)4-7(3-5)16-9(10,11)12/h2-4H,13H2,1H3

InChIKey

InChIKey=FVKIOMRKUGGDPD-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)C=1C=C(SC(F)(F)F)C=C(N)C1

Other Names for this Substance

  • Benzoic acid, 3-amino-5-[(trifluoromethyl)thio]-, methyl ester
  • Methyl 3-amino-5-[(trifluoromethyl)thio]benzoate