HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,1-Dimethylethyl N-[4-(bromomethyl)-2-pyridinyl]carbamate
![1,1-Dimethylethyl N-[4-(bromomethyl)-2-pyridinyl]carbamate molecular structure](/img/chemical/22097736.png)
Identifiers & Physical Properties
| CAS No. | 190189-98-1 |
|---|---|
| Molecular formula | C11H15BrN2O2 |
| Average molar mass | 287.15 g/mol |
| SMILES | CC(C)(C)OC(=O)Nc1cc(CBr)ccn1 |
| InChIKey | TWFAMEOZPYPOIV-UHFFFAOYSA-N |
| PubChem CID | 22097736 |
Chemical & Physical Properties
| XLogP | 2.3 |
|---|---|
| Topological polar surface area | 51.2 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 4 |
| Heavy atoms | 16 |
| Formal charge | 0 |
| Complexity | 241 |