1,3-Dimethyl 2-[3-cyano-5-(trifluoromethyl)-2-pyridinyl]propanedioate

CAS Registry Number®

2055119-00-9
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CAS Name

1,3-Dimethyl 2-[3-cyano-5-(trifluoromethyl)-2-pyridinyl]propanedioate

Molecular Formula

C12H9F3N2O4

Molecular Mass

302.21

Cite this Page

1,3-Dimethyl 2-[3-cyano-5-(trifluoromethyl)-2-pyridinyl]propanedioate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2055119-00-9 (retrieved 2024-09-05) (CAS RN: 2055119-00-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H9F3N2O4/c1-20-10(18)8(11(19)21-2)9-6(4-16)3-7(5-17-9)12(13,14)15/h3,5,8H,1-2H3

InChIKey

InChIKey=ZJGFKRBBQGSZLY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC(=CN=C1C(C(=O)OC)C(=O)OC)C(F)(F)F

Other Names for this Substance

  • Propanedioic acid, 2-[3-cyano-5-(trifluoromethyl)-2-pyridinyl]-, 1,3-dimethyl ester
  • 1,3-Dimethyl 2-[3-cyano-5-(trifluoromethyl)-2-pyridinyl]propanedioate