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111453-32-8

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111453-32-8 Structure

111453-32-8 Structure

Identification	Back Directory
[Name] 3-AMino-5-[[(2,3-dihydroxypropyl)aMino]carbonyl]-2,4,6-triiodo-benzoic Acid
[CAS] 111453-32-8
[Synonyms] SKL423 Iohexol impurity Iohexol Impurity 24 Iohexol EP Impurity 3 Iohexol Impurities1486 5-AMino-N-(2,3-dihydroxypropyl)-2,4,6-triiodoisophthalaMide Acid 3-AMino-5-[[(2,3-dihydroxypropyl)aMino]carbonyl]-2,4,6-triiodo-benzoic Acid Benzoic acid, 3-amino-5-[[(2,3-dihydroxypropyl)amino]carbonyl]-2,4,6-triiodo-
[Molecular Formula] C11H11I3N2O5
[MDL Number] MFCD27977177
[MOL File] 111453-32-8.mol
[Molecular Weight] 631.93

Chemical Properties	Back Directory
[Boiling point ] 599.1±50.0 °C(Predicted)
[density ] 2.641±0.06 g/cm3(Predicted)
[storage temp. ] Refrigerator
[form ] Solid
[pka] 1.22±0.10(Predicted)
[color ] White
[InChI] InChI=1S/C11H11I3N2O5/c12-6-4(10(19)16-1-3(18)2-17)7(13)9(15)8(14)5(6)11(20)21/h3,17-18H,1-2,15H2,(H,16,19)(H,20,21)
[InChIKey] URFBLIYCWAORDM-UHFFFAOYSA-N
[SMILES] C(O)(=O)C1=C(I)C(C(NCC(O)CO)=O)=C(I)C(N)=C1I

Safety Data	Back Directory
[Symbol(GHS) ] GHS05
[Signal word ] Danger
[Hazard statements ] H314
[Precautionary statements ] P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
[REACH Registrations] Active

Hazard Information	Back Directory
[Chemical Properties] White Solid
[Uses] Intermediate in the preparation of Iopromide.

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