HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 105421Generated: October 25, 2026
Benzenemethanol, 4-(1,1-dimethylethyl)-, 1-acetate
Benzenemethanol, 4-(1,1-dimethylethyl)-, acetate · Einecs 266-669-8 · 4-tert-Butylbenzyl acetate · p-(tert-butyl)benzyl acetate · Acetic acid 4-tert-butylbenzyl ester · 1-(Acetoxymethyl)-4-tert-butylbenzene · Acetic acid, p-(tert-butyl)benzyl ester · 4-(1,1-Dimethylethyl)benzenemethanol acetate
https://huagongshe.com/en/chemical/105421
Identifiers & Physical Properties
| CAS No. | 67364-88-9 |
|---|
| Molecular formula | C13H18O2 |
|---|
| Average molar mass | 206.28 g/mol |
|---|
| Monoisotopic mass | 206.13067982 g/mol |
|---|
| SMILES | CC(=O)OCc1ccc(C(C)(C)C)cc1 |
|---|
| InChIKey | QSCOAHKJRIJKQZ-UHFFFAOYSA-N |
|---|
| PubChem CID | 105421 |
|---|
| EC No. | 266-669-8 |
|---|
| DTXSID | DTXSID20886828 |
|---|
Chemical & Physical Properties
| XLogP | 3.7 |
|---|
| Topological polar surface area | 26.3 |
|---|
| Hydrogen bond donors | 0 |
|---|
| Hydrogen bond acceptors | 2 |
|---|
| Rotatable bonds | 4 |
|---|
| Heavy atoms | 15 |
|---|
| Formal charge | 0 |
|---|
| Complexity | 207 |
|---|
| EPA Substance Registry System | Benzenemethanol, 4-(1,1-dimethylethyl)-, acetate (67364-88-9) |
|---|
| TSCA inventory status | TSCA listed |
|---|
Safety & Regulations
| TSCA inventory status | TSCA listed |
|---|