HuagongsheHuagongshe Chemistry Print Report · For research reference only
Ethyl-2-methyl-4-(2-bromophenyl)-pyrimidine-5-carboxylate
Identifiers & Physical Properties
| Molecular formula | C14H13BrN2O2 |
|---|---|
| Average molar mass | 321.17 g/mol |
| SMILES | CCOC(=O)c1cnc(C)nc1-c1ccccc1Br |
| InChIKey | KQUNJRBKUQPTPM-UHFFFAOYSA-N |
| PubChem CID | 22831713 |
Chemical & Physical Properties
| XLogP | 3.2 |
|---|---|
| Topological polar surface area | 52.1 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 4 |
| Heavy atoms | 19 |
| Formal charge | 0 |
| Complexity | 314 |