Molecule record

4-(hydroxymethyl)benzonitrile

C8H7NO

133.15 g/mol

Loading structure

Molecular properties

Formula
C8H7NO
Molar mass
133.15 g·mol−1
Exact mass
133.0528 Da
6
PubChem CID
160549

Functional groups

Alcohol
Alkane / alkyl carbon
Aromatic ring
Nitrile

Physical properties

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

Common names and synonyms

  • (4-cyanophenyl)methanol
  • 4(hydroxymethyl)-benzonitrile
  • 4-(Hydroxymethyl)benzonitrile #
  • 4-Cyanobenzyl alcohol
  • 4-Cyanobeznyl alcohol
  • 4-Hydroxymethyl-benzonitrile
  • 4-cyanobenzenemeth
  • 4-cyanobenzenemethanol
Show all 24 synonyms
  • 628-080-8
  • 874-89-5
  • A23220
  • AKOS000249162
  • Benzonitrile, 4-(hydroxymethyl)-
  • CCRIS 5116
  • DTXCID90158822
  • DTXSID90236331
  • F0001-0101
  • MFCD00870633
  • RefChem:858046
  • SCHEMBL128283
  • SCHEMBL595992
  • SCHEMBL92970
  • SY025114
  • p-Cyanobenzyl alcohol

Structure identifiers

Canonical SMILES
N#Cc1ccc(CO)cc1
Isomeric SMILES
C1=CC(=CC=C1CO)C#N
InChI
InChI=1S/C8H7NO/c9-5-7-1-3-8(6-10)4-2-7/h1-4,10H,6H2
InChIKey
XAASLEJRGFPHEV-UHFFFAOYSA-N
PubChem CID
160549

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-(hydroxymethyl)benzonitrile; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-(hydroxymethyl)benzonitrile; 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