Basic information
- CAS
78314-12-2- Standard SMILES
CC(=O)OCC(=O)Nc1c(I)c(C(=O)Cl)c(I)c(C(=O)Cl)c1I- InChIKey
PQZLQOGLMSANKA-UHFFFAOYSA-N- Molecular formula
- C12H6Cl2I3NO5
- Average molar mass
- 695.8 g/mol
- Monoisotopic mass
- 694.67572165
Names & identifiers
- Preferred name
- 5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl dichloride
- IUPAC
- [2-(3,5-dicarbonochloridoyl-2,4,6-triiodoanilino)-2-oxoethyl] acetate
- English name
- 5-[[2-(Acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride
- Molecular formula
- C12H6Cl2I3NO5
- Molecular weight
- 695.8
Names & synonyms
78314-12-25-[[2-(ACETYLOXY)ACETYL]AMINO]-2,4,6-TRIIODO-1,3-BENZENEDICARBONYL DICHLORIDE[2-(3,5-dicarbonochloridoyl-2,4,6-triiodoanilino)-2-oxoethyl] acetatePQZLQOGLMSANKA-UHFFFAOYSA-NSCHEMBL708587DTXSID105135502-((3,5-BIS(CHLOROCARBONYL)-2,4,6-TRIIODOPHENYL)AMINO)-2-OXOETHYL ACETATEDB-253305F813425-acetoxyacetamido-2,4,6-triiodoisophthaloyl chloride2-[3,5-Bis(chlorocarbonyl)-2,4,6-triiodoanilino]-2-oxoethyl acetateAcetic acid (3,5-bis-chlorocarbonyl-2,4,6-triiodo-phenylcarbamoyl)-methyl ester
Show more names
IoversolImpurity10Ioversol Impurity 55-[[(Acetyloxy)acetyl]aMino]-2,4,6-triiodo-1,3-benzenedicarbonyl Dichloride1,3-Benzenedicarbonyl dichloride, 5-[[(acetyloxy)acetyl]amino]-2,4,6-triiodo-1,3-Benzenedicarbonyl dichloride, 5-[[2-(acetyloxy)acetyl]amino]-2,4,6-triiodo-
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 89.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 493
Physicochemical properties
- solubility
- Chloroform
Chemistry & industry
Applications
UsesIntermediate in the production of contrast agents for X-ray imaging.
Upstream & downstream products
Downstream products
Suppliers18 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
深圳菲斯生物科技有限公司0755-83725681-603
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
Related reactions
3 records
Compound notes
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