Molecular properties
- Formula
- C10H12O2
- Molar mass
- 164.20 g·mol−1
- Exact mass
- 164.0837 Da
- 5
- PubChem CID
- 18752374
Molecule record
3-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
- 3-Propyl-benzoic acid
- 3-propylbenzoicacid
- 857539-83-4
- A10610
- AKOS023362451
- AS-57266
- CS-0199479
- DB-252562
Show all 19 synonyms
- EN300-99366
- MFCD20644163
- SCHEMBL10755484
- SCHEMBL17046282
- SCHEMBL30354557
- SCHEMBL4651360
- SCHEMBL7472698
- SCHEMBL7521628
- SCHEMBL991080
- SY362041
- m-propylbenzoic acid
Structure identifiers
- Canonical SMILES
- CCCc1cccc(C(=O)O)c1
- Isomeric SMILES
- CCCC1=CC(=CC=C1)C(=O)O
- InChI
- InChI=1S/C10H12O2/c1-2-4-8-5-3-6-9(7-8)10(11)12/h3,5-7H,2,4H2,1H3,(H,11,12)
- InChIKey
- GIFHXKJTAILWRE-UHFFFAOYSA-N
- PubChem CID
- 18752374
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 3-propylbenzoic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-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.