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Chemical structure of Diatrizoate

GC30335

Diatrizoate

Also listed as Diatrizoic acid (Amidotrizoic acid)

Diatrizoic acid (Amidotrizoic acid) (Diatrizoate) is an iodinated radiocontrast agent and has the potential for radiographic imaging of the airways

ChemicalCAS117-96-4MW613.91FormulaC11H9I3N2O4
CAS number
117-96-4
Molecular weight
613.91
Formula
C11H9I3N2O4
Solubility
DMSO ： ≥ 40 mg/mL (65·16 mM)
InChIKey
YVPYQUNUQOZFHG-UHFFFAOYSA-N
Catalogue number
GC30335
Brand
GLPBIO
Computed properties PubChem CID 2140 · XLogP 1.8 · TPSA 95.5 Ų · H-bond donors 3
XLogP
1.8
TPSA
95.5 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20

SMILES CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)NC(=O)C)I

Computed descriptors from PubChem (CID 2140), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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