4-(5-Pentyl-2-pyrimidinyl)benzonitrile

CAS Registry Number®

59855-05-9

CAS Name

4-(5-Pentyl-2-pyrimidinyl)benzonitrile

Molecular Formula

C16H17N3

Molecular Mass

251.33

Cite this Page

4-(5-Pentyl-2-pyrimidinyl)benzonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=59855-05-9 (retrieved 2024-11-23) (CAS RN: 59855-05-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H17N3/c1-2-3-4-5-14-11-18-16(19-12-14)15-8-6-13(10-17)7-9-15/h6-9,11-12H,2-5H2,1H3

InChIKey

InChIKey=RGONNDWSVOCREF-UHFFFAOYSA-N

SMILES

C(CCCC)C=1C=NC(=NC1)C2=CC=C(C#N)C=C2

Canonical SMILES

N#CC=1C=CC(=CC1)C2=NC=C(C=N2)CCCCC

Other Names for this Substance

  • Benzonitrile, 4-(5-pentyl-2-pyrimidinyl)-
  • 4-(5-Pentyl-2-pyrimidinyl)benzonitrile
  • p-(5-Pentyl-2-pyrimidinyl)benzonitrile
  • 5-Pentyl-2-(4-cyanophenyl)pyrimidine
  • 5CNPYR

View All

Deleted or Replaced CAS Registry Numbers

119467-18-4, 64835-55-8

CAS INSIGHTSTM
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