Ethyl 4-(3-cyano-2-pyridinyl)benzoate

CAS Registry Number®

1208081-99-5
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CAS Name

Ethyl 4-(3-cyano-2-pyridinyl)benzoate

Molecular Formula

C15H12N2O2

Molecular Mass

252.27

Cite this Page

Ethyl 4-(3-cyano-2-pyridinyl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1208081-99-5 (retrieved 2024-08-28) (CAS RN: 1208081-99-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    98-100 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C15H12N2O2/c1-2-19-15(18)12-7-5-11(6-8-12)14-13(10-16)4-3-9-17-14/h3-9H,2H2,1H3

InChIKey

InChIKey=SEVLKWHXNIQVSH-UHFFFAOYSA-N

SMILES

C(#N)C1=C(N=CC=C1)C2=CC=C(C(OCC)=O)C=C2

Canonical SMILES

N#CC1=CC=CN=C1C=2C=CC(=CC2)C(=O)OCC

Other Names for this Substance

  • Benzoic acid, 4-(3-cyano-2-pyridinyl)-, ethyl ester
  • Ethyl 4-(3-cyano-2-pyridinyl)benzoate