HuagongsheHuagongshe Chemistry Print Report · For research reference only
3-Carboxyphenyl((N-((4-iodophenyl)acetyl)amino)methyl)phosphonate
m-Ciaamp · 3-carboxyphenyl((N-((4-iodophenyl)acetyl)amino)methyl)phosphonate · Benzoic acid, 3-[[hydroxy[[[2-(4-iodophenyl)acetyl]amino]methyl]phosphinyl]oxy]-
Identifiers & Physical Properties
| CAS No. | 156483-88-4 |
|---|---|
| Molecular formula | C16H15INO6P |
| Average molar mass | 475.17 g/mol |
| Monoisotopic mass | 474.96817 g/mol |
| SMILES | O=C(Cc1ccc(I)cc1)NCP(=O)(O)Oc1cccc(C(=O)O)c1 |
| InChIKey | XKIXOGFDDUEBHT-UHFFFAOYSA-N |
| PubChem CID | 190841 |
| DTXSID | DTXSID90166088 |
Chemical & Physical Properties
| XLogP | 1.9 |
|---|---|
| Topological polar surface area | 113 |
| Hydrogen bond donors | 3 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 7 |
| Heavy atoms | 25 |
| Formal charge | 0 |
| Complexity | 523 |