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Diatrizoate sodium  Structure

Diatrizoate sodium

Chemical Properties

Melting point 261-262° (dec)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  H2O: 0.35 g/mL, slightly turbid, colorless
form  White Powder
BRN  4082984
InChI InChI=1S/C11H9I3N2O4.Na/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);/q;+1/p-1
InChIKey ZEYOIOAKZLALAP-UHFFFAOYSA-M
SMILES C1(NC(=O)C)C(I)=C(C(I)=C(C([O-])=O)C=1I)NC(=O)C.[Na+]
CAS DataBase Reference 737-31-5(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII V5403H8VG7
EPA Substance Registry System Benzoic acid, 3,5-bis(acetylamino)-2,4,6-triiodo-, monosodium salt (737-31-5)

Safety

Symbol(GHS)
Signal wordDanger
Hazard statements H317-H334
Precautionary statements P261-P280-P342+P311
Hazard Codes  Xn
Risk Statements  42/43
Safety Statements  36
WGK Germany  3
RTECS  DG6125000
8-10
HS Code  29242100
Hazardous Substances Data 737-31-5(Hazardous Substances Data)
Toxicity LD50 i.v. in rats: 14.7 g/kg (Langecker)

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