50978-11-5
Product Name:
Diatrizoic Acid Dihydrate
Formula:
C11H11I3N2O5
Synonyms:
3,5-Bis(acetylamino)-2,4,6-triiodobenzoic acid dihydrate;Amidotrizoic Acid;Amidotrizoic acid dihydrate;Diatrizoic acid dihydrate;NSC 262168
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COMPUTED DESCRIPTORS
| Molecular Weight | 649.94 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 649.7908 g/mol |
| Monoisotopic Mass | 649.7908 g/mol |
| Topological Polar Surface Area | 97.5 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 391 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Amidotrizoic acid dihydrate is the dihydrate form of amidotrizoic acid. Both the dihydrate and the anhydrous form are used as X-ray contrast media. It has a role as a radioopaque medium. It contains an amidotrizoic acid.