ioversol
1-N,3-N-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxamide
| Molecular Formula | C18H24I3N3O9 |
|---|---|
| Molecular Weight | 807.1 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 200.0 A2 |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 806.8647 |
| Heavy Atoms | 33 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 87771-40-2 |
|---|---|
| SMILES | C(CO)N(C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCC(CO)O)I)C(=O)CO |
| InChIKey | AMDBBAQNWSUWGN-UHFFFAOYSA-N |
📖 Product Overview
ioversol (CAS: 87771-40-2) is a chemical compound with molecular formula C18H24I3N3O9 and molecular weight 807.1 g/mol. Its IUPAC systematic name is 1-N,3-N-bis(2,3-dihydroxypropyl)-5-[(2-hydroxyacetyl)-(2-hydroxyethyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxamide.
AMDBBAQNWSUWGN-UHFFFAOYSA-N.
SMILES: C(CO)N(C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCC(CO)O)I)C(=O)CO.
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