3-Oxazolo[4,5-b]pyridin-2-ylbenzonitrile

CAS Registry Number®

52334-91-5
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CAS Name

3-Oxazolo[4,5-b]pyridin-2-ylbenzonitrile

Molecular Formula

C13H7N3O

Molecular Mass

221.21

Cite this Page

3-Oxazolo[4,5-b]pyridin-2-ylbenzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52334-91-5 (retrieved 2024-08-08) (CAS RN: 52334-91-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    151-154 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C13H7N3O/c14-8-9-3-1-4-10(7-9)13-16-12-11(17-13)5-2-6-15-12/h1-7H

InChIKey

InChIKey=IWRDDVSHWWYSRO-UHFFFAOYSA-N

SMILES

C(#N)C=1C=C(C2=NC=3C(O2)=CC=CN3)C=CC1

Canonical SMILES

N#CC1=CC=CC(=C1)C2=NC3=NC=CC=C3O2

Other Names for this Substance

  • Benzonitrile, 3-oxazolo[4,5-b]pyridin-2-yl-
  • Oxazolo[4,5-b]pyridine, benzonitrile deriv.
  • 3-Oxazolo[4,5-b]pyridin-2-ylbenzonitrile
  • 3-[[1,3]Oxazolo[4,5-b]pyridin-2-yl]benzonitrile