Tert-butyl 2-methylbenzoate
tert-butyl 2-methylbenzoate
Also Known As: tert-butyl 2-methylbenzoate|tert-butyl2-methylbenzoate|o-toluic acid t-butyl ester|1,1-Dimethylethyl 2-methylbenzoate|Benzoic acid, 2-methyl-, 1,1-dimethylethyl ester|2-Methylbenzoic acid tert-butyl ester|Benzoic acid,2-methyl-, 1,1-dimethylethyl ester|J2.303.303H
CAS: 20133-69-1
| Molecular Formula | C12H16O2 |
|---|---|
| Molecular Weight | 192.11504 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.11504 |
| Monoisotopic Mass | 192.11504 |
| Heavy Atoms | 14 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 20133-69-1 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)OC(C)(C)C |
| InChIKey | OTTAPBBGMIZOPJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (2 patents)
Pharmaceutical Intermediates (1 patents)
Polymer Intermediates (1 patents)
Product Overview
Tert-butyl 2-methylbenzoate (CAS 20133-69-1), with molecular formula C12H16O2 and molecular weight 192.11504 g/mol. IUPAC: tert-butyl 2-methylbenzoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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