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

CAS Registry Number®

74240-64-5

CAS Name

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

Molecular Formula

C14H17NO2

Molecular Mass

231.29

Cite this Page

4-(trans-5-Propyl-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=74240-64-5 (retrieved 2024-11-22) (CAS RN: 74240-64-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C14H17NO2/c1-2-3-12-9-16-14(17-10-12)13-6-4-11(8-15)5-7-13/h4-7,12,14H,2-3,9-10H2,1H3/t12-,14-

InChIKey

InChIKey=GQPFCPRCGONDNN-MQMHXKEQNA-N

SMILES

C(CC)[C@H]1CO[C@@H](OC1)C2=CC=C(C#N)C=C2

Canonical SMILES

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

Other Names for this Substance

  • Benzonitrile, 4-(trans-5-propyl-1,3-dioxan-2-yl)-
  • Benzonitrile, 4-(5-propyl-1,3-dioxan-2-yl)-, trans-
  • 4-(trans-5-Propyl-1,3-dioxan-2-yl)benzonitrile
  • trans-4-(5-Propyl-1,3-dioxan-2-yl)benzonitrile