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CAS 52-60-8

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Phosphorothioic acid, O-[3,5-dimethyl-4-(methylthio)phenyl] O,O-diethyl ester

Description:
Phosphorothioic acid, O-[3,5-dimethyl-4-(methylthio)phenyl] O,O-diethyl ester, commonly known by its CAS number 52-60-8, is an organophosphorus compound characterized by its phosphorothioate structure. This compound features a phosphorus atom bonded to sulfur and oxygen, with two ethyl ester groups and a substituted aromatic ring containing both methyl and methylthio groups. It is typically a colorless to pale yellow liquid with a distinctive odor. The presence of the phosphorothioate functional group imparts specific biological activity, often associated with insecticidal and herbicidal properties. As an organophosphate, it may exhibit neurotoxic effects by inhibiting acetylcholinesterase, an enzyme critical for nerve function. Due to its potential environmental and health impacts, its use is regulated in many jurisdictions. Proper handling and safety measures are essential when working with this compound, as it can pose risks to human health and the ecosystem.
Formula:C13H21O3PS2
InChI:InChI=1S/C13H21O3PS2/c1-6-14-17(18,15-7-2)16-12-8-10(3)13(19-5)11(4)9-12/h8-9H,6-7H2,1-5H3
InChI key:InChIKey=RYYJMLJORHNGST-UHFFFAOYSA-N
SMILES:P(OC1=CC(C)=C(SC)C(C)=C1)(OCC)(OCC)=S
Synonyms:
  • Phosphorothioic acid, O-[3,5-dimethyl-4-(methylthio)phenyl] O,O-diethyl ester
  • Bayer 37341
  • O,O-Diethyl O-[4-(methylthio)-3,5-xylyl] phosphorothioate
  • Phosphorothioic acid, O,O-diethyl O-[4-(methylthio)-3,5-xylyl] ester
  • 3,5-Xylenol, 4-(methylthio)-, O-ester with O,O-diethyl phosphorothioate
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