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
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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
J A Gustafsson et al.
Nutrition and cancer, 2(4), 224-231 (1981-01-01)
The metabolism of four xenobiotics, pentachloromethylthiobenzene, 2-chloro-n-iso-propylacetanilide, 2-acetamido-4-(chloromethyl) thiazole and 2,4',5-trichlorobiphenyl, which are known to be metabolized via the mercapturic acid pathway, was examined in germfree and conventional rats. An essential role for the intestinal flora in the metabolism of
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
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)
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
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