Molecular properties
- Formula
- C11H16
- Molar mass
- 148.25 g·mol−1
- Exact mass
- 148.1252 Da
- 4
- PubChem CID
- 33712
Molecule record
1-tert-butyl-2-methylbenzene
C11H16
148.25 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
- (1,1-Dimethylethyl)methylbenzene
- 1-(1,1-dimethylethyl)-2-methylbenzene
- 1-Methyl-2-tert-butylbenzene
- 1-Tert-butyl-2-methylbenzene;1-(tert-Butyl)-2-methylbenzene
- 1-tert-butyl-2-methyl-benzene
- 1074-92-6
- 2-METHYL-TERT-BUTYLBENZENE
- 2-t-Butyltoluene
Show all 24 synonyms
- 2-tert-Butyltoluene
- 27138-21-2
- 677-962-9
- Benzene, (1,1-dimethylethyl)methyl-
- Benzene, 1-(1,1-dimethylethyl)-2-methyl-
- DTXCID6033081
- DTXSID7075056
- EZ8LVG9BTU
- MFCD00059209
- NSC-23694
- O-METHYL-TERT-BUTYLBENZENE
- RefChem:855327
- Toluene, o-tert-butyl-
- o-t-butyltoluene
- o-tert-Butyltoluene
- t-butyltoluene
Structure identifiers
- Canonical SMILES
- Cc1ccccc1C(C)(C)C
- Isomeric SMILES
- CC1=CC=CC=C1C(C)(C)C
- InChI
- InChI=1S/C11H16/c1-9-7-5-6-8-10(9)11(2,3)4/h5-8H,1-4H3
- InChIKey
- AXHVNJGQOJFMHT-UHFFFAOYSA-N
- PubChem CID
- 33712
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 1-tert-butyl-2-methylbenzene; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-tert-butyl-2-methylbenzene; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.