Molecule record

2-methylundecane

C12H26

170.34 g/mol

Loading structure

Molecular properties

Formula
C12H26
Molar mass
170.34 g·mol−1
Exact mass
170.2035 Da
0
PubChem CID
23459

Functional groups

Alkane / alkyl carbon

Physical properties

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

Common names and synonyms

  • 2-METHYL UNDECANE
  • 2-Methylhendecane
  • 230-323-4
  • 31807-55-3
  • 7045-71-8
  • DTXCID5021590
  • DTXSID50873241
  • EINECS 230-323-4
Show all 24 synonyms
  • EINECS 250-816-8
  • H40FL8477B
  • ISODODECANE
  • MFCD00036106
  • RefChem:476305
  • SCHEMBL137369
  • SCHEMBL1417513
  • SCHEMBL1683289
  • SCHEMBL198290
  • SCHEMBL36787
  • SCHEMBL56464
  • SCHEMBL739205
  • UNII-H40FL8477B
  • Undecane, 2-methyl-
  • Undecane, 2methyl
  • isodo-decane

Structure identifiers

Canonical SMILES
CCCCCCCCCC(C)C
Isomeric SMILES
CCCCCCCCCC(C)C
InChI
InChI=1S/C12H26/c1-4-5-6-7-8-9-10-11-12(2)3/h12H,4-11H2,1-3H3
InChIKey
GTJOHISYCKPIMT-UHFFFAOYSA-N
PubChem CID
23459

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 2-methylundecane; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-methylundecane; 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