4-(Acetyloxy)benzonitrile

CAS Registry Number®

13031-41-9

CAS Name

4-(Acetyloxy)benzonitrile

Molecular Formula

C9H7NO2

Molecular Mass

161.16

Cite this Page

4-(Acetyloxy)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13031-41-9 (retrieved 2024-11-21) (CAS RN: 13031-41-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    149-150 °C @ Press: 14 Torr

  • Melting Point (2)

    57 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H7NO2/c1-7(11)12-9-4-2-8(6-10)3-5-9/h2-5H,1H3

InChIKey

InChIKey=CJGXWABHYYJNJH-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CC1=CC=C(OC(=O)C)C=C1

Other Names for this Substance

  • Benzonitrile, 4-(acetyloxy)-
  • Benzonitrile, p-hydroxy-, acetate (ester)
  • Benzonitrile, p-hydroxy-, acetate
  • 4-(Acetyloxy)benzonitrile
  • p-Acetoxybenzonitrile

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration