1-Chloro-1λ3,2-benziodoxol-3-one

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1-Chloro-1λ3,2-benziodoxol-3-one Basic information
Product Name:1-Chloro-1λ3,2-benziodoxol-3-one
Synonyms:1-Chloro-1λ3,2-benziodoxol-3-one;3H-1,2-Benziodoxol-3-one, 1-chloro-;1-Chloro-1,2-benziodoxol-3(1H)-one 98.0-102.0% (AT);1-Chloro-1,2-benziodoxol-3-one, 98%;1-chloro-1,2-benziodoxolin-3-one;1-chloro-1λ3 -benzo[d][1,2]iodaoxol-3(1H)-one;1-Chloro-1,2-benziodoxol-3(1H)-one;1-Chloro-1,2-benziodoxol-3(1H)-one - [C15861]
CAS:59457-26-0
MF:C7H4ClIO2
MW:282.46
EINECS:
Product Categories:
Mol File:59457-26-0.mol
1-Chloro-1λ3,2-benziodoxol-3-one Structure
1-Chloro-1λ3,2-benziodoxol-3-one Chemical Properties
Melting point 172-173 °C
storage temp. 2-8°C
solubility DMSO (Slightly, Sonicated), Methanol (Slightly, Heated, Sonicated)
form Solid
color White to Light Yellow
BRN 141400
Stability:Moisture Sensitive
InChIInChI=1S/C7H4ClIO2/c8-9-6-4-2-1-3-5(6)7(10)11-9/h1-4H
InChIKeyXSZMFYQLHGJKKD-UHFFFAOYSA-N
SMILESI1(Cl)C2=CC=CC=C2C(=O)O1
Safety Information
WGK Germany WGK 3
HS Code 29349990
Storage Class11 - Combustible Solids
Hazard ClassificationsEye Irrit. 2
Skin Irrit. 2
STOT SE 3
MSDS Information
1-Chloro-1λ3,2-benziodoxol-3-one Usage And Synthesis
Uses1-Chloro-1,2-benziodoxol-3(1H)-one is an intermediate in the synthesis of 3-((5-Chloro-4-(pyridin-3-yl)pyrimidin-2-yl)amino)-4-methyl-N-(3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl)benzamide (C179120), an impurity of Nilotinib (N465300), which might be useful in treatment of chronic myelogenous leukemia.
1-Chloro-1λ3,2-benziodoxol-3-one Preparation Products And Raw materials
Preparation Products1-TrifluoroMethyl-1,2-benziodoxol-3(1H)-one
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