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Merck
CN

467936

3,4,5-Trichloropyridine

98%

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About This Item

Empirical Formula (Hill Notation):
C5H2Cl3N
CAS Number:
Molecular Weight:
182.44
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
98%
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Quality Level

assay

98%

mp

75-77 °C (dec.) (lit.)

functional group

chloro

SMILES string

Clc1cncc(Cl)c1Cl

InChI

1S/C5H2Cl3N/c6-3-1-9-2-4(7)5(3)8/h1-2H

InChI key

KKWRVUBDCJQHBZ-UHFFFAOYSA-N

General description

3,4,5-Trichloropyridine is a pyridine derivative. It undergoes oxidation with trifluoroacetic anhydride (TFAA) in the presence of hydrogen peroxide urea complex.

Application

3,4,5-Trichloropyridine may be employed as a secondary standard in quantitative NMR (qNMR) studies.


pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves



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A practical, efficient, and rapid method for the oxidation of electron deficient pyridines using trifluoroacetic anhydride and hydrogen peroxide-urea complex.
Caron S, et al.
Tetrahedron Letters, 41(14), 2299-2302 (2000)
Torgny Rundlöf et al.
Journal of pharmaceutical and biomedical analysis, 52(5), 645-651 (2010-03-09)
In quantitative NMR (qNMR) selection of an appropriate internal standard proves to be crucial. In this study, 25 candidate compounds considered to be potent internal standards were investigated with respect to the ability of providing unique signal chemical shifts, purity
Torgny Rundlöf et al.
Journal of pharmaceutical and biomedical analysis, 93, 111-117 (2013-11-12)
Standards are required in quantitative NMR (qNMR) to obtain accurate and precise results. In this study acetanilide was established and used as a primary standard. Six other chemicals were selected as secondary standards: 3,4,5-trichloropyridine, dimethylterephthalate, maleic acid, 3-sulfolene, 1,4-bis(trimethylsilyl)benzene, and



Global Trade Item Number

SKUGTIN
467936-1G04061825754055