33367
Methyl-pentachlorophenylsulfide
PESTANAL®, analytical standard
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About This Item
Empirical Formula (Hill Notation):
C7H3Cl5S
CAS Number:
Molecular Weight:
296.43
EC Number:
217-363-8
UNSPSC Code:
41116107
PubChem Substance ID:
Beilstein/REAXYS Number:
2214412
MDL number:
InChI key
LGZZJTIUEJNNKV-UHFFFAOYSA-N
InChI
1S/C7H3Cl5S/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h1H3
SMILES string
CSc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
grade
analytical standard
product line
PESTANAL®
shelf life
limited shelf life, expiry date on the label
technique(s)
HPLC: suitable, NMR: suitable, gas chromatography (GC): suitable
mp
92-96 °C
suitability
passes test for identity (NMR)
application(s)
agriculture
environmental
format
neat
Application
Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
Legal Information
PESTANAL is a registered trademark of Merck KGaA, Darmstadt, Germany
hcodes
Hazard Classifications
Aquatic Chronic 4
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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J E Bakke et al.
Xenobiotica; the fate of foreign compounds in biological systems, 20(6), 601-605 (1990-06-01)
1. Biliary metabolites from rats dosed with pentachlorothioanisole (PCTA) were characterized by fast atom bombardment mass spectrometry and electron impact mass spectrometry. 2. Most of the biliary metabolites from PCTA were mercapturic acid pathway metabolites of methylsulphinyltetrachlorobenzene (51% of the
D J Mulford et al.
Xenobiotica; the fate of foreign compounds in biological systems, 21(5), 597-603 (1991-05-01)
1. The metabolism of pentachlorothioanisole to bis-(methylthio)tetrachlorobenzene was shown to involve turnover of about 50% of the original methylthio group. 2. Metabolites of the displaced methylthio group were methanesulphinic acid and sulphate in the urine, carbon dioxide in the expired
Hexachlorobenzene (HCB) and some of its sulfur-containing metabolites: tissue retention and excretion routes in mice.
I Brandt et al.
Developments in toxicology and environmental science, 8, 627-630 (1980-01-01)
Cara L Ferreira et al.
Bioconjugate chemistry, 23(11), 2239-2246 (2012-10-06)
In this study, a bifunctional version of the chelate PCTA was compared to the analogous NOTA derivative for peptide conjugation, (68)Ga radiolabeling, and small peptide imaging. Both p-SCN-Bn-PCTA and p-SCN-Bn-NOTA were conjugated to cyclo-RGDyK. The resulting conjugates, PCTA-RGD and NOTA-RGD
Y Kato et al.
Journal of pharmacobio-dynamics, 13(5), 278-284 (1990-05-01)
Effects of hexachlorobenzene (HCB) and its sulfur-containing metabolites on the heme metabolic enzymes in rat liver were investigated. A single injection of HCB caused the increase in activities of delta-aminolevulinic acid (ALA) synthetase and heme oxygenase, and contents of cytochrome
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