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Methyl(2,3,4,5,6-pentahydroxyhexyl)azanium;2,4,6-triiodo-3-(methylcarbamoyl)-5-(propanoylamino)benzoate

CAS
67314-29-8
Catalog Number
ACM67314298
Category
Other Products
Molecular Weight
823.154 g/mol
Molecular Formula
C19H28I3N3O9

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Specification

Synonyms
Isophthalamic acid, N-methyl-5-propionylamino-2,4,6-triiodo-, N-methylglucamine salt, N-Methyl-5-propionylamino-2,4,6-triiodoisophthalamic acid N-methylglucamine salt, AC1L2MD8, LS-85199, 67314-29-8, methyl(2,3,4,5,6-pentahydroxyhexyl)azanium; 2,4,6-triiodo-3-(methylcarbamoyl)-5-(propanoylamino)benzoate
IUPAC Name
methyl(2,3,4,5,6-pentahydroxyhexyl)azanium;2,4,6-triiodo-3-(methylcarbamoyl)-5-(propanoylamino)benzoate
Canonical SMILES
CCC(=O)NC1=C(C(=C(C(=C1I)C(=O)[O-])I)C(=O)NC)I.C[NH2+]CC(C(C(C(CO)O)O)O)O
InChI Key
PEDXMZAJBPKUJB-UHFFFAOYSA-N
Boiling Point
529.2ºC at 760 mmHg
Flash Point
273.8ºC
Exact Mass
822.89600
H-Bond Acceptor
9
H-Bond Donor
8
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