Molecular properties
- Formula
- C9H7NO2
- Molar mass
- 161.16 g·mol−1
- Exact mass
- 161.0477 Da
- 7
- PubChem CID
- 83062
Molecule record
(4-cyanophenyl) acetate
C9H7NO2
161.16 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Ester
Ether
Nitrile
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 13031-41-9
- 235-893-8
- 4-(Acetyloxy)benzonitrile
- 4-Acetoxybenzonitrile
- 4-cyanophenylacetate
- AKOS006241748
- BENZONITRILE, P-HYDROXY-, ACETATE
- Benzonitrile, 4-(acetyloxy)-
Show all 24 synonyms
- Benzonitrile, p-hydroxy-, acetate (ester)
- CS-0444219
- DB-367691
- DTXCID707741
- DTXSID8027741
- EC 235-893-8
- EEL1PCP8AM
- EINECS 235-893-8
- MFCD00129158
- NS00007236
- P-ACETOXYBENZONITRILE
- RefChem:858047
- SCHEMBL14659838
- SCHEMBL337646
- UNII-EEL1PCP8AM
- p-Cyanophenyl acetate
Structure identifiers
- Canonical SMILES
- CC(=O)Oc1ccc(C#N)cc1
- Isomeric SMILES
- CC(=O)OC1=CC=C(C=C1)C#N
- InChI
- InChI=1S/C9H7NO2/c1-7(11)12-9-4-2-8(6-10)3-5-9/h2-5H,1H3
- InChIKey
- CJGXWABHYYJNJH-UHFFFAOYSA-N
- PubChem CID
- 83062
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 (4-cyanophenyl) acetate; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for (4-cyanophenyl) acetate; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.