Iotrolan CAS 79770-24-4

Introduction：Basic information about Iotrolan CAS 79770-24-4, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Iotrolan Basic information

• Product Name: Iotrolan
• Synonyms: Isovist 300;SHL 437AA;ZK 39482;IOTROLAN(ISOVIST);5,5'-[(1,3-Dioxo-1,3-propanediyl)bis(methylimino)]bis[N,N'-bis[2,3-dihydroxy-1-(hydroxymethyl)propyl]-2,4,6-triiodo-1,3-benzenedicarboxamide];2,4,6-triiodo-5-[methyl-[3-[methyl-[2,4,6-triiodo-3,5-bis(1,3,4-trihydroxybutan-2-ylcarbamoyl)phenyl]amino]-3-oxo-propanoyl]amino]-N1,N3-bis(1,3,4-trihydroxybutan-2-yl)benzene-1,3-dicarboxamide;2,4,6-triiodo-5-[methyl-[3-oxo-3-[2,4,6-triiodo-N-methyl-3,5-bis(1,3,4-trihydroxybutan-2-ylcarbamoyl)anilino]propanoyl]amino]-1-N,3-N-bis(1,3,4-trihydroxybutan-2-yl)benzene-1,3-dicarboxamide;5-[[3-[3,5-bis[(2,3-dihydroxy-1-methylol-propyl)carbamoyl]-2,4,6-triiodo-N-methyl-anilino]-3-keto-propanoyl]-methyl-amino]-N,N'-bis(2,3-dihydroxy-1-methylol-propyl)-2,4,6-triiodo-isophthalamide
• CAS: 79770-24-4
• MF: C37H48I6N6O18
• MW: 1626.23
• Mol File: 79770-24-4.mol

Iotrolan Chemical Properties

• Boiling point: 1390.4±65.0 °C(Predicted)
• density: 2.316±0.06 g/cm3(Predicted)
• storage temp.: 2-8°C
• solubility: Very soluble in water, freely soluble in dimethyl sulfoxide, practically insoluble in ethanol (96 per cent).
• pka: 5.51±0.70(Predicted)
• Major Application: pharmaceutical (small molecule)
• InChIKey: XUHXFSYUBXNTHU-UHFFFAOYSA-N
• SMILES: Ic1c(c(c(c(c1C(=O)NC(C(O)CO)CO)I)C(=O)NC(C(O)CO)CO)I)N(C)C(=O)CC(=O)N(C)c2c(c(c(c(c2I)C(=O)NC(C(O)CO)CO)I)C(=O)NC(C(O)CO)CO)I

Safety Information

• Toxicity: LD50 in mice, rats (gI/kg): >26, 12.7 i.v. (Sovak, 1982)

Iotrolan Usage And Synthesis

Chemical Properties

White or yellowish-white powder, hygroscopic.

Uses

Diagnostic aid (radiopaquemedium).

Definition

ChEBI: Iotrolan is an organic molecular entity.

Brand name

Osmovist (Berlex).