4-(5-Pentyl-1,3-dioxan-2-yl)benzonitrile

CAS Registry Number®

74800-62-7

CAS Name

4-(5-Pentyl-1,3-dioxan-2-yl)benzonitrile

Molecular Formula

C16H21NO2

Molecular Mass

259.34

Cite this Page

4-(5-Pentyl-1,3-dioxan-2-yl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=74800-62-7 (retrieved 2024-11-21) (CAS RN: 74800-62-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H21NO2/c1-2-3-4-5-14-11-18-16(19-12-14)15-8-6-13(10-17)7-9-15/h6-9,14,16H,2-5,11-12H2,1H3

InChIKey

InChIKey=SSXIKUCDZOQOKB-UHFFFAOYSA-N

SMILES

C(CCCC)C1COC(OC1)C2=CC=C(C#N)C=C2

Canonical SMILES

N#CC1=CC=C(C=C1)C2OCC(CO2)CCCCC

Other Names for this Substance

  • Benzonitrile, 4-(5-pentyl-1,3-dioxan-2-yl)-
  • 4-(5-Pentyl-1,3-dioxan-2-yl)benzonitrile
  • 2-(4-Cyanophenyl)-5-n-pentyl-1,3-dioxane