HuagongsheHuagongshe Chemistry Print Report · For research reference only
Malonaldehyde, bromo-, sodium deriv (7CI)
Identifiers & Physical Properties
| CAS No. | 41711-29-9 |
|---|---|
| Molecular formula | C3H2BrNaO2 |
| Average molar mass | 172.94 g/mol |
| Monoisotopic mass | 171.91359 g/mol |
| SMILES | O=C[C-](Br)C=O.[Na+] |
| InChIKey | DKPFQIXGHAIRIA-UHFFFAOYSA-N |
| PubChem CID | 23688984 |
| DTXSID | DTXSID80194512 |
Chemical & Physical Properties
| Topological polar surface area | 34.1 |
|---|---|
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 2 |
| Heavy atoms | 7 |
| Formal charge | 0 |
| Complexity | 58 |