HuagongsheHuagongshe Chemistry Print Report · For research reference only
4-Iodophenylalanine i-123
Identifiers & Physical Properties
| CAS No. | 60345-87-1 |
|---|---|
| Molecular formula | C9H10INO2 |
| Average molar mass | 287.09 g/mol |
| Monoisotopic mass | 286.97674256 g/mol |
| SMILES | N[C@@H](Cc1ccc([123I])cc1)C(=O)O |
| InChIKey | PZNQZSRPDOEBMS-GBVUCJOHSA-N |
| PubChem CID | 450220 |
| DTXSID | DTXSID90209106 |
Chemical & Physical Properties
| XLogP | -0.9 |
|---|---|
| Topological polar surface area | 63.3 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 3 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 178 |