1,1-Dimethylethyl 3-chloro-α-cyano-5-(trifluoromethyl)-2-pyridineacetate

CAS Registry Number®

1426290-06-3
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CAS Name

1,1-Dimethylethyl 3-chloro-α-cyano-5-(trifluoromethyl)-2-pyridineacetate

Molecular Formula

C13H12ClF3N2O2

Molecular Mass

320.69

Cite this Page

1,1-Dimethylethyl 3-chloro-α-cyano-5-(trifluoromethyl)-2-pyridineacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1426290-06-3 (retrieved 2024-08-04) (CAS RN: 1426290-06-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12ClF3N2O2/c1-12(2,3)21-11(20)8(5-18)10-9(14)4-7(6-19-10)13(15,16)17/h4,6,8H,1-3H3

InChIKey

InChIKey=WDISDGYOJULGDE-UHFFFAOYSA-N

SMILES

C(C(OC(C)(C)C)=O)(C#N)C1=C(Cl)C=C(C(F)(F)F)C=N1

Canonical SMILES

N#CC(C(=O)OC(C)(C)C)C1=NC=C(C=C1Cl)C(F)(F)F

Other Names for this Substance

  • 2-Pyridineacetic acid, 3-chloro-α-cyano-5-(trifluoromethyl)-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 3-chloro-α-cyano-5-(trifluoromethyl)-2-pyridineacetate
  • tert-Butyl 2-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-2-cyanoacetate