Products 76350-23-7

CAS 76350-23-7 is the registry number for Iohexol Impurity 14. Offered by: Chemat Brand. Available pack sizes: on request.

Iohexol Impurity 14
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

5-acetamido-3-N-(1,3-dihydroxypropan-2-yl)-1-N-(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide (CAS 76350-23-7) is a chemical compound with the molecular formula C16H20I3N3O7 and a molecular weight of 747.06 g/mol. IUPAC name: 5-acetamido-3-N-(1,3-dihydroxypropan-2-yl)-1-N-(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide. InChIKey: PUPFJAVRTQKSQG-UHFFFAOYSA-N.

Identity
Molecular formulaC16H20I3N3O7
Molecular weight747.06 g/mol
IUPAC name5-acetamido-3-N-(1,3-dihydroxypropan-2-yl)-1-N-(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
InChIKeyPUPFJAVRTQKSQG-UHFFFAOYSA-N
SMILESCC(=O)NC1=C(C(=C(C(=C1I)C(=O)NC(CO)CO)I)C(=O)NCC(CO)O)I

Computed by PubChem (NCBI)

Synonyms: Iodixanol Impurity 13
Isomers (same molecular formula)
5-acetamido-1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide C16H20I3N3O7
3-N-(1,3-dihydroxypropan-2-yl)-1-N-(2-hydroxyethyl)-5-(2-hydroxypropanoylamino)-2,4,6-triiodobenzene-1,3-dicarboxamide C16H20I3N3O7
5-acetamido-1-N,3-N-bis(1,3-dihydroxypropan-2-yl)-2,4,6-triiodobenzene-1,3-dicarboxamide C16H20I3N3O7
3-N-(1,3-dihydroxypropan-2-yl)-1-N-(2-hydroxyethyl)-5-[[(2S)-2-hydroxypropanoyl]amino]-2,4,6-triiodobenzene-1,3-dicarboxamide C16H20I3N3O7