Molecular properties
- Formula
- C11H22O2
- Molar mass
- 186.29 g·mol−1
- Exact mass
- 186.1620 Da
- 1
- PubChem CID
- 568363
Molecule record
ethyl 2-methyloctanoate
C11H22O2
186.29 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Ester
Ether
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 2-methyl-octanoic acid ethyl ester
- 30982-02-6
- AKOS006316519
- BS-22289
- DTXSID10340888
- Ethyl 2-methyloctanoate #
- Octanoic acid, 2-methyl-, ethyl ester
- SCHEMBL29155994
Show all 9 synonyms
- SCHEMBL3673850
Structure identifiers
- Canonical SMILES
- CCCCCCC(C)C(=O)OCC
- Isomeric SMILES
- CCCCCCC(C)C(=O)OCC
- InChI
- InChI=1S/C11H22O2/c1-4-6-7-8-9-10(3)11(12)13-5-2/h10H,4-9H2,1-3H3
- InChIKey
- HRJHQOXWONBAJC-UHFFFAOYSA-N
- PubChem CID
- 568363
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 ethyl 2-methyloctanoate; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for ethyl 2-methyloctanoate; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.