Diatrizoic Acid Dihydrate
- Product NameDiatrizoic Acid Dihydrate
- CAS50978-11-5
- CBNumberCB1191671
- MFC11H11I3N2O5
- MW631.93
- EINECS204-223-6
- MDL NumberMFCD06408002
- MOL File50978-11-5.mol
Chemical Properties
| storage temp. | 2-8°C |
| solubility | Very slightly soluble in water and in ethanol (96 per cent). It dissolves in dilute solutions of alkali hydroxides. |
| pka | pKa 3.4 (Uncertain) |
| Stability | Light Sensitive |
| Major Application | pharmaceutical (small molecule) |
| InChI | InChI=1S/C11H9I3N2O4.H2O/c1-3(17)15-9-6(12)5(11(19)20)7(13)10(8(9)14)16-4(2)18;/h1-2H3,(H,15,17)(H,16,18)(H,19,20);1H2 |
| InChIKey | JHQKUXXJPHSPOL-UHFFFAOYSA-N |
| SMILES | N(C1C(=C(NC(=O)C)C(I)=C(C(=O)O)C=1I)I)C(=O)C.O |
| CAS DataBase Reference | 50978-11-5(CAS DataBase Reference) |
| FDA UNII | 408463F217 |
| ATC code | V08AA01 |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |
