CAS Registry Number®
117-96-4
CAS Name
Diatrizoate
Molecular Formula
C11H9I3N2O4
Molecular Mass
613.91
Compound Properties
-
Melting Point (1)
>300 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
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)
InChIKey
InChIKey=YVPYQUNUQOZFHG-UHFFFAOYSA-N
SMILES
N(C(C)=O)C1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I
Canonical SMILES
O=C(O)C=1C(I)=C(NC(=O)C)C(I)=C(NC(=O)C)C1I
Other Names for this Substance
- Benzoic acid, 3,5-bis(acetylamino)-2,4,6-triiodo-
- Benzoic acid, 3,5-diacetamido-2,4,6-triiodo-
- 3,5-Bis(acetylamino)-2,4,6-triiodobenzoic acid
- Amidotrizoic acid
- Diatrizoate
- Diatrizoic acid
- 2,4,6-Triiodo-3,5-diacetamidobenzoic acid
- Odiston
- Urografin acid
- Urotrast
- 3,5-Diacetamido-2,4,6-triiodobenzoic acid
- Urogranoic acid
- NSC 262168
- MeSH ID: D003973
