Molecule record

methyl 2-methyloctadecanoate

C20H40O2

312.54 g/mol

Loading structure

Molecular properties

Formula
C20H40O2
Molar mass
312.54 g·mol−1
Exact mass
312.3028 Da
1
PubChem CID
102828

Functional groups

Alkane / alkyl carbon
Ester
Ether

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 2490-22-4
  • DTXSID40947788
  • Methyl 2-methyloctadecanoate #
  • Methyl 2-methyloctadecanoic acid
  • Methyl 2-methylstearate
  • OVWHQBWRKHEQPM-UHFFFAOYSA-N
  • Octadecanoic acid, 2-methyl-, methyl ester
  • SCHEMBL2534208
Show all 9 synonyms
  • methyl a-methyl-stearate

Structure identifiers

Canonical SMILES
CCCCCCCCCCCCCCCCC(C)C(=O)OC
Isomeric SMILES
CCCCCCCCCCCCCCCCC(C)C(=O)OC
InChI
InChI=1S/C20H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)20(21)22-3/h19H,4-18H2,1-3H3
InChIKey
OVWHQBWRKHEQPM-UHFFFAOYSA-N
PubChem CID
102828

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for methyl 2-methyloctadecanoate; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for methyl 2-methyloctadecanoate; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record