3-Methyl-β-oxo-2-pyridinepropanenitrile

CAS Registry Number®

59718-85-3

CAS Name

3-Methyl-β-oxo-2-pyridinepropanenitrile

Molecular Formula

C9H8N2O

Molecular Mass

160.17

Cite this Page

3-Methyl-β-oxo-2-pyridinepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59718-85-3 (retrieved 2024-11-22) (CAS RN: 59718-85-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    93-95 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H8N2O/c1-7-3-2-6-11-9(7)8(12)4-5-10/h2-3,6H,4H2,1H3

InChIKey

InChIKey=WFPWYSFNRMIWAJ-UHFFFAOYSA-N

SMILES

C(CC#N)(=O)C1=C(C)C=CC=N1

Canonical SMILES

N#CCC(=O)C1=NC=CC=C1C

Other Names for this Substance

  • 2-Pyridinepropanenitrile, 3-methyl-β-oxo-
  • 3-Methyl-β-oxo-2-pyridinepropanenitrile