Molecule record

1-methylimidazole

C4H6N2

82.11 g/mol

Loading structure

Molecular properties

Formula
C4H6N2
Molar mass
82.11 g·mol−1
Exact mass
82.0531 Da
3
PubChem CID
1390

Functional groups

Alkane / alkyl carbon

Physical properties

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

Common names and synonyms

  • 1-Methyl-1H-imidazole
  • 1-Methyl-1H-imidazole; Thiamazole Imp. B (EP); Thiamazole Impurity B
  • 1-methyl-1H-imidazol-3-ium
  • 1-methyl-imidazole
  • 1-methylimdazole
  • 1-methylimidazol
  • 1H-Imidazole, 1-methyl-
  • 210-484-7
Show all 24 synonyms
  • 616-47-7
  • Araldite DY 070
  • CHEBI:113454
  • DTXCID6030863
  • DTXSID6052291
  • EINECS 210-484-7
  • IMIDAZOLE, 1-METHYL-
  • MFCD00005292
  • N-Methylimidazole
  • N-methylimidazol
  • N1-Methylimidazole
  • NSC-88064
  • P4617QS63Y
  • RefChem:76394
  • UNII-P4617QS63Y
  • n-methyl imidazole

Structure identifiers

Canonical SMILES
Cn1ccnc1
Isomeric SMILES
CN1C=CN=C1
InChI
InChI=1S/C4H6N2/c1-6-3-2-5-4-6/h2-4H,1H3
InChIKey
MCTWTZJPVLRJOU-UHFFFAOYSA-N
PubChem CID
1390

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 1-methylimidazole; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 1-methylimidazole; 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