3-[3-(1,3-Dioxan-2-yl)-1-oxopropyl]benzonitrile

CAS Registry Number®

898756-70-2
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CAS Name

3-[3-(1,3-Dioxan-2-yl)-1-oxopropyl]benzonitrile

Molecular Formula

C14H15NO3

Molecular Mass

245.27

Cite this Page

3-[3-(1,3-Dioxan-2-yl)-1-oxopropyl]benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898756-70-2 (retrieved 2024-07-07) (CAS RN: 898756-70-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H15NO3/c15-10-11-3-1-4-12(9-11)13(16)5-6-14-17-7-2-8-18-14/h1,3-4,9,14H,2,5-8H2

InChIKey

InChIKey=XPIWAIAJDKHREO-UHFFFAOYSA-N

SMILES

C(CCC1OCCCO1)(=O)C2=CC(C#N)=CC=C2

Canonical SMILES

N#CC1=CC=CC(=C1)C(=O)CCC2OCCCO2

Other Names for this Substance

  • Benzonitrile, 3-[3-(1,3-dioxan-2-yl)-1-oxopropyl]-
  • 3-[3-(1,3-Dioxan-2-yl)-1-oxopropyl]benzonitrile