3 5-Dichloropyridine 1-oxide 98

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3 5-Dichloropyridine 1-oxide 98 Basic information
Preparation
Product Name:3 5-Dichloropyridine 1-oxide 98
Synonyms:3,5-Dichloropyridine N-oxide 98%;Pyridine,3,5-dichloro-, 1-oxide;TAK438 Impurity 96;Vonoprazan Impurity 96;Vonoprazan Impuirty101;3,5-dicholoropyridine N-oxide;3,5-Dichloropyridine N-oxide;3,5-Dichloropyridine N-oxide
CAS:15177-57-8
MF:C5H3Cl2NO
MW:163.99
EINECS:200-613-5
Product Categories:C5Heterocyclic Building Blocks;Halogenated Heterocycles;Heterocyclic Building Blocks;Pyridines;pharmacetical
Mol File:15177-57-8.mol
3 5-Dichloropyridine 1-oxide 98 Structure
3 5-Dichloropyridine 1-oxide 98 Chemical Properties
Melting point 110-113 °C(lit.)
Boiling point 344.2±22.0 °C(Predicted)
density 1.47±0.1 g/cm3 (20 ºC 760 Torr)
storage temp. Room temperature.
pka-0.72±0.10(Predicted)
form solid
InChI1S/C5H3Cl2NO/c6-4-1-5(7)3-8(9)2-4/h1-3H
InChIKeyRODXBOIDZPQDBH-UHFFFAOYSA-N
SMILES[O-][n+]1cc(Cl)cc(Cl)c1
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36-24/25
WGK Germany 3
HS Code 29333990
Storage Class11 - Combustible Solids
Hazard ClassificationsEye Irrit. 2
Skin Irrit. 2
STOT SE 3
MSDS Information
3 5-Dichloropyridine 1-oxide 98 Usage And Synthesis
Preparation3,5-difluoropyridine-N-oxide is prepared by the following steps:A solution of (5) (0.37 g, 3 mmol), peracetic acid ( 1.5 cm3 of 40% solution in  acetic acid) in acetic acid (5 cm3) and chloroform (10 cm3) was heated at 50 "C, with  stirring, for 24 h. The mixture was neutralised by the addition of dilute sodium hydroxide  to the chilled mixture, then remaining peroxides were destroyed by the addition of  sodium metabisulphite (2 g). Following extraction into DCM, the DCM solution was  dried (MgS04) and evaporated to dryness giving a solid which was recrystallised from  DCM- petrol (1: 1) to yield 3,5-difluoropyridine-N-oxide (0.3 g, 71 %), m.p. 136.5 "C  (Found: C, 45.5; H, 2.3; N, 10.1. C5H3F2NO requires C, 45.8; H, 2.3; N, 10.7%); IR  spectra no. 23; mass spectra no. 31; nmr spectrum no. 21.
3 5-Dichloropyridine 1-oxide 98 Preparation Products And Raw materials
Raw materials3,5-Dichloropyridine
Tag:3 5-Dichloropyridine 1-oxide 98(15177-57-8) Related Product Information
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