HuagongsheHuagongshe Chemistry Print Report · For research reference only
4,6-Dimethoxypyrimidine-2-carbonyl chloride
2-Pyrimidinecarbonyl chloride, 4,6-dimethoxy- · 2-Pyrimidinecarbonyl chloride, 4,6-dimethoxy- (9CI)

Identifiers & Physical Properties
| CAS No. | 509101-33-1 |
|---|---|
| Molecular formula | C7H7ClN2O3 |
| Average molar mass | 202.59 g/mol |
| Monoisotopic mass | 202.01451976 g/mol |
| SMILES | COc1cc(OC)nc(C(=O)Cl)n1 |
| InChIKey | KKBJQXDTMNKTBX-UHFFFAOYSA-N |
| PubChem CID | 23020244 |
| DTXSID | DTXSID80629839 |
Chemical & Physical Properties
| XLogP | 1.7 |
|---|---|
| Topological polar surface area | 61.3 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 5 |
| Rotatable bonds | 3 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 179 |