CAS 96191-65-0|Ioxabrolic acid

Introduction:Basic information about CAS 96191-65-0|Ioxabrolic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameIoxabrolic acid
CAS Number96191-65-0Molecular Weight1127.88000
Density2.345g/cm3Boiling Point847ºC at 760 mmHg
Molecular FormulaC24H21Br3I3N5O8Melting Point/
MSDS/Flash Point466ºC

Names

Name3-[[2-[[3-[acetyl(methyl)amino]-2,4,6-tribromo-5-(methylcarbamoyl)benzoyl]amino]acetyl]amino]-5-(2-hydroxyethylcarbamoyl)-2,4,6-triiodobenzoic acid
SynonymMore Synonyms

Chemical & Physical Properties

Density2.345g/cm3
Boiling Point847ºC at 760 mmHg
Molecular FormulaC24H21Br3I3N5O8
Molecular Weight1127.88000
Flash Point466ºC
Exact Mass1124.61000
PSA194.24000
LogP5.16470
Index of Refraction1.744
InChIKeyOJCPHFBLBNKCNX-UHFFFAOYSA-N
SMILESCNC(=O)c1c(Br)c(C(=O)NCC(=O)Nc2c(I)c(C(=O)O)c(I)c(C(=O)NCCO)c2I)c(Br)c(N(C)C(C)=O)c1Br

Synonyms

Ioxabrolic acid
UNII-LP80S8XS18
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