Molecule record

4-prop-2-enylbenzonitrile

C10H9N

143.19 g/mol

Loading structure

Molecular properties

Formula
C10H9N
Molar mass
143.19 g·mol−1
Exact mass
143.0735 Da
7
PubChem CID
9855503

Functional groups

Alkane / alkyl carbon
Alkene
Aromatic ring
Nitrile

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 3-(4-CYANOPHENYL)-1-PROPENE
  • 4-(prop-2-en-1-yl)benzonitrile
  • 4-allyl-benzonitrile
  • 4-allylbenzonitrile
  • 51980-05-3
  • AKOS006280100
  • Benzonitrile, 4-(2-propenyl)-
  • CS-0530877
Show all 17 synonyms
  • DB-316185
  • DTXCID20382633
  • DTXSID30431803
  • EN300-698367
  • F200208
  • MFCD01319568
  • RefChem:289695
  • SCHEMBL991288
  • ULDJSHVPTSCBDW-UHFFFAOYSA-N

Structure identifiers

Canonical SMILES
C=CCc1ccc(C#N)cc1
Isomeric SMILES
C=CCC1=CC=C(C=C1)C#N
InChI
InChI=1S/C10H9N/c1-2-3-9-4-6-10(8-11)7-5-9/h2,4-7H,1,3H2
InChIKey
ULDJSHVPTSCBDW-UHFFFAOYSA-N
PubChem CID
9855503

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 4-prop-2-enylbenzonitrile; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-prop-2-enylbenzonitrile; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record