Molecular properties
- Formula
- C9H7NO2
- Molar mass
- 161.16 g·mol−1
- Exact mass
- 161.0477 Da
- 7
- PubChem CID
- 79587
Molecule record
2-(4-cyanophenyl)acetic acid
C9H7NO2
161.16 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Carboxylic acid
Nitrile
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (4-Cyano-phenyl)-acetic acid
- (4-Cyanophenyl)acetic acid #
- (p-Cyanophenyl)acetic acid
- 2-(4-Cyanophenyl)aceticacid
- 226-753-7
- 333406-09-0
- 4-Cyanobenzeneacetic acid
- 4-Cyanophenyl acetic acid
Show all 24 synonyms
- 4-Cyanophenylacetic acid
- 4-cyano-phenylacetic acid
- 5462-71-5
- Acetic acid, (p-cyanophenyl)-
- Benzeneacetic acid, 4-cyano-
- DTXCID00125545
- DTXSID00203054
- EINECS 226-753-7
- MFCD06798066
- NSC-14104
- RefChem:98657
- SCHEMBL335492
- UNII-YJK6AE7K3P
- WEBXRQONNWEETE-UHFFFAOYSA-N
- YJK6AE7K3P
- orb3175565
Structure identifiers
- Canonical SMILES
- N#Cc1ccc(CC(=O)O)cc1
- Isomeric SMILES
- C1=CC(=CC=C1CC(=O)O)C#N
- InChI
- InChI=1S/C9H7NO2/c10-6-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5H2,(H,11,12)
- InChIKey
- WEBXRQONNWEETE-UHFFFAOYSA-N
- PubChem CID
- 79587
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 2-(4-cyanophenyl)acetic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-(4-cyanophenyl)acetic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.