Molecular properties
- Formula
- C8H12N2
- Molar mass
- 136.20 g·mol−1
- Exact mass
- 136.1000 Da
- 4
- PubChem CID
- 94597
Molecule record
2-tert-butylpyrimidine
C8H12N2
136.20 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 2-(1,1-Dimethylethyl)pyrimidine
- 2-t-Butylpyrimidine
- 2-tert.butyl-pyrimidine
- 61319-99-1
- AKOS006272277
- DTXCID4043014
- DTXSID1073579
- PXEJBTJCBLQUKS-UHFFFAOYSA-N
Show all 14 synonyms
- Pyrimidine, 2-(1,1-dimethylethyl)-
- RefChem:377497
- SCHEMBL179267
- SCHEMBL5711286
- SCHEMBL662736
- SCHEMBL788327
Structure identifiers
- Canonical SMILES
- CC(C)(C)c1ncccn1
- Isomeric SMILES
- CC(C)(C)C1=NC=CC=N1
- InChI
- InChI=1S/C8H12N2/c1-8(2,3)7-9-5-4-6-10-7/h4-6H,1-3H3
- InChIKey
- PXEJBTJCBLQUKS-UHFFFAOYSA-N
- PubChem CID
- 94597
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-tert-butylpyrimidine; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 2-tert-butylpyrimidine; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.