Molecular properties
- Formula
- C18H28O2
- Molar mass
- 276.42 g·mol−1
- Exact mass
- 276.2089 Da
- 5
- PubChem CID
- 67727103
Molecule record
2-undecylbenzoic acid
C18H28O2
276.42 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
- SCHEMBL8925891
Structure identifiers
- Canonical SMILES
- CCCCCCCCCCCc1ccccc1C(=O)O
- Isomeric SMILES
- CCCCCCCCCCCC1=CC=CC=C1C(=O)O
- InChI
- InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-13-16-14-11-12-15-17(16)18(19)20/h11-12,14-15H,2-10,13H2,1H3,(H,19,20)
- InChIKey
- HUJPLUDVBXXDDJ-UHFFFAOYSA-N
- PubChem CID
- 67727103
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-undecylbenzoic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-undecylbenzoic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.