4′-Heptyl-4-cyanobiphenyl

CAS Registry Number®

41122-71-8
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CAS Name

4′-Heptyl-4-cyanobiphenyl

Molecular Formula

C20H23N

Molecular Mass

277.40

Cite this Page

4′-Heptyl-4-cyanobiphenyl.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=41122-71-8 (retrieved 2024-04-29) (CAS RN: 41122-71-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    196-199 °C @ Press: 2 Torr
  • Melting Point (2)

    30 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H23N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h8-15H,2-7H2,1H3

InChIKey

InChIKey=ZGOWXOZNUNZPAV-UHFFFAOYSA-N

SMILES

C(CCCCCC)C1=CC=C(C=C1)C2=CC=C(C#N)C=C2

Canonical SMILES

N#CC=1C=CC(=CC1)C2=CC=C(C=C2)CCCCCCC

Other Names for this Substance

  • [1,1′-Biphenyl]-4-carbonitrile, 4′-heptyl-
  • 4′-Heptyl[1,1′-biphenyl]-4-carbonitrile
  • 4-Cyano-4′-heptylbiphenyl
  • 4′-Heptyl-4-cyanobiphenyl
  • 4′-Heptyl-4-biphenylcarbonitrile

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