Molecular properties
- Formula
- C11H16
- Molar mass
- 148.25 g·mol−1
- Exact mass
- 148.1252 Da
- 4
- PubChem CID
- 7390
Molecule record
1-tert-butyl-4-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-(1,1-DIMETHYLETHYL)-4-METHYLBENZENE
- 1-Methyl-4-tert-butylbenzene
- 202-675-9
- 4-Methyl-tert-butylbenzene
- 4-T-BUTYLTOLUENE
- 4-tert-Butyl-1-methylbenzene
- 4-tert-Butyltoluene
- 589519D43L
Show all 24 synonyms
- 8-Methylparacymene
- 98-51-1
- AI3-26435
- Benzene, 1-(1,1-dimethylethyl)-4-methyl-
- Benzene, 1-methyl-4-(1,1-dimethylethyl)-
- DTXCID404704
- DTXSID1024704
- NSC-6589
- PTBT
- RefChem:100526
- Toluene, p-tert-butyl-
- p-Methyl-tert-butylbenzene
- p-TBT
- p-t-Butyltoluene
- p-tert-Butyltoluene
- para-tert-butyltoluene
Structure identifiers
- Canonical SMILES
- Cc1ccc(C(C)(C)C)cc1
- Isomeric SMILES
- CC1=CC=C(C=C1)C(C)(C)C
- InChI
- InChI=1S/C11H16/c1-9-5-7-10(8-6-9)11(2,3)4/h5-8H,1-4H3
- InChIKey
- QCWXDVFBZVHKLV-UHFFFAOYSA-N
- PubChem CID
- 7390
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-4-methylbenzene; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-tert-butyl-4-methylbenzene; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.