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pyroxasulfone Structure

pyroxasulfone

Chemical Properties

Boiling point 418.1±55.0 °C(Predicted)
Density  1.59±0.1 g/cm3(Predicted)
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka -3.23±0.10(Predicted)
color  White to Off-White
InChI InChI=1S/C12H14F5N3O4S/c1-11(2)4-7(19-24-11)25(21,22)5-6-8(12(15,16)17)18-20(3)9(6)23-10(13)14/h10H,4-5H2,1-3H3
InChIKey CASLETQIYIQFTQ-UHFFFAOYSA-N
SMILES O1C(C)(C)CC(S(CC2=C(OC(F)F)N(C)N=C2C(F)(F)F)(=O)=O)=N1
FDA UNII 04XP114422
EPA Substance Registry System Isoxazole, 3-[[[5-(difluoromethoxy)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl]methyl]sulfonyl]-4,5-dihydro-5,5-dimethyl- (447399-55-5)

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