Molecular properties
- Formula
- C10H12O2
- Molar mass
- 164.20 g·mol−1
- Exact mass
- 164.0837 Da
- 5
- PubChem CID
- 137601
Molecule record
4-propylbenzoic acid
C10H12O2
164.20 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Carboxylic acid
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 2438-05-3
- 3P1V85E45O
- 4-Propylbenzoic acid, 97%
- 4-n-Propylbenzoic acid
- 4-n-propyl benzoic acid
- 4-propyl benzoic acid
- 607-366-6
- AC-18362
Show all 24 synonyms
- AC7845
- AKOS000153018
- AS-10796
- Benzoic acid, 4-propyl-
- DTXCID3026564
- DTXSID5046564
- MFCD00013996
- NCGC00166226-01
- NSC-168993
- P-PROPYLBENZOIC ACID
- Propyl p-benzoate
- Q27257838
- RefChem:526582
- Tox21_112358
- p-Propyl benzoic acid
- p-n-Propyl benzoic acid
Structure identifiers
- Canonical SMILES
- CCCc1ccc(C(=O)O)cc1
- Isomeric SMILES
- CCCC1=CC=C(C=C1)C(=O)O
- InChI
- InChI=1S/C10H12O2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,2-3H2,1H3,(H,11,12)
- InChIKey
- ATZHGRNFEFVDDJ-UHFFFAOYSA-N
- PubChem CID
- 137601
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-propylbenzoic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-propylbenzoic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.