Details
Stereochemistry | ACHIRAL |
Molecular Formula | C11H9I3N2O4 |
Molecular Weight | 613.9136 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I
InChI
InChIKey=YVPYQUNUQOZFHG-UHFFFAOYSA-N
InChI=1S/C11H9I3N2O4/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)
Molecular Formula | C11H9I3N2O4 |
Molecular Weight | 613.9136 |
Charge | 0 |
Count |
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Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:08:22 UTC 2023
by
admin
on
Fri Dec 15 15:08:22 UTC 2023
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Record UNII |
5UVC90J1LK
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C390
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NDF-RT |
N0000180185
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WHO-VATC |
QV08AA01
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WHO-ATC |
V08AA01
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NDF-RT |
N0000010258
Created by
admin on Fri Dec 15 15:08:22 UTC 2023 , Edited by admin on Fri Dec 15 15:08:22 UTC 2023
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Code System | Code | Type | Description | ||
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DB00271
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m4263
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PRIMARY | Merck Index | ||
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100000091574
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59733
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C016826
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C47483
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DTXSID0044521
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Diatrizoate
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4042
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1184005
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5UVC90J1LK
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DIATRIZOIC ACID
Created by
admin on Fri Dec 15 15:08:22 UTC 2023 , Edited by admin on Fri Dec 15 15:08:22 UTC 2023
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PRIMARY | Description: A white or almost white, crystalline powder; odourless. Solubility: Very slightly soluble in water and ethanol (~750 g/l) TS; soluble in dimethylformamide R; sparingly soluble in methanol R; practically insoluble in ether R; dissolves in solutions of alkali hydroxides. Category: Used in the preparation of meglumine amidotrizoate as a radiocontrast medium. Storage: Amidotrizoic acid should be kept in a well-closed container, protected from light. Labelling: The designation on the container of amidotrizoic acid should state whether the substance is the dihydrate or the anhydrous form. Requirement: Amidotrizoic acid contains not less than 98.0% and not more than the equivalent of 102.0% of C11H9I3N2O4, calculated with reference to the dried substance. | ||
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SUB00443MIG
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5UVC90J1LK
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117-96-4
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262168
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851
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1546223
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D003973
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DIATRIZOIC ACID
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2140
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CHEMBL1201220
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204-223-6
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3319
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53691
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Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT | |||
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SOLVATE->ANHYDROUS | |||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT | |||
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SALT/SOLVATE -> PARENT |
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IMPURITY -> PARENT | |||
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IMPURITY -> PARENT | |||
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IMPURITY -> PARENT | |||
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PARENT -> IMPURITY | |||
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IMPURITY -> PARENT | |||
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IMPURITY -> PARENT |
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ACTIVE MOIETY |