3-[3-[2-[3-[3-carboxy-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]anilino]-3-oxopropoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid structure
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Common Name | 3-[3-[2-[3-[3-carboxy-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]anilino]-3-oxopropoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid | ||
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| CAS Number | 26090-54-0 | Molecular Weight | 1394.04000 | |
| Density | 2.391g/cm3 | Boiling Point | 1118.1ºC at 760mmHg | |
| Molecular Formula | C32H32I6N4O10 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 630ºC | |
| Name | 3-[3-[2-[3-[3-carboxy-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]anilino]-3-oxopropoxy]ethoxy]propanoylamino]-2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid |
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| Synonym | More Synonyms |
| Density | 2.391g/cm3 |
|---|---|
| Boiling Point | 1118.1ºC at 760mmHg |
| Molecular Formula | C32H32I6N4O10 |
| Molecular Weight | 1394.04000 |
| Flash Point | 630ºC |
| Exact Mass | 1393.64000 |
| PSA | 198.86000 |
| LogP | 7.52080 |
| Vapour Pressure | 0mmHg at 25°C |
| Index of Refraction | 1.77 |
| InChIKey | KEPNWUOCHSRHGY-UHFFFAOYSA-N |
| SMILES | O=C(CCOCCOCCC(=O)Nc1c(I)c(CN2CCCC2=O)c(I)c(C(=O)O)c1I)Nc1c(I)c(CN2CCCC2=O)c(I)c(C(=O)O)c1I |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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| 2,4,6,2',4',6'-hexaiodo-5,5'-bis-(2-oxo-pyrrolidin-1-ylmethyl)-3,3'-(4,7-dioxa-decanedioyldiamino)-bis-benzoic acid |
| Benzoic acid,3,3'-(ethylenebis(oxyethylenecarbonylimino))bis(5-(2-oxo-1-pyrrolidinylmethyl)-2,4,6-triiodo |
| 3,3'-{ethane-1,2-diylbis[oxy(1-oxopropane-3,1-diyl)imino]}bis{2,4,6-triiodo-5-[(2-oxopyrrolidin-1-yl)methyl]benzoic acid} |