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Merck
CN

467936

3,4,5-三氯吡啶

98%

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经验公式(希尔记法):
C5H2Cl3N
化学文摘社编号:
分子量:
182.44
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
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产品名称

3,4,5-三氯吡啶, 98%

InChI

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

SMILES string

Clc1cncc(Cl)c1Cl

InChI key

KKWRVUBDCJQHBZ-UHFFFAOYSA-N

assay

98%

mp

75-77 °C (dec.) (lit.)

functional group

chloro

Quality Level

Application

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

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.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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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
Shi Shen et al.
Journal of pharmaceutical and biomedical analysis, 114, 190-199 (2015-06-13)
This study investigated the accuracy of the quantitative NMR method for purity determination of ACE inhibitors reference standards and the discovery of two pairs of new diastereoisomers. Six types of ACE inhibitors, imidapril hydrochloride, benazepril hydrochloride, lisinopril, enalapril maleate, quinapril
Monika Johansson et al.
Journal of pharmaceutical and biomedical analysis, 100, 215-229 (2014-08-30)
An effective screening procedure to identify and quantify active pharmaceutical substances in suspected illegal medicinal products is described. The analytical platform, consisting of accurate mass determination with liquid chromatography time-of-flight mass spectrometry (LC-QTOF-MS) in combination with nuclear magnetic resonance (NMR)

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