Cas no 142383-74-2 (1,2-Benzisothiazol-3(2H)-one, 5-chloro-2-methyl-)

1,2-Benzisothiazol-3(2H)-one, 5-chloro-2-methyl- structure
142383-74-2 structure
Product Name:1,2-Benzisothiazol-3(2H)-one, 5-chloro-2-methyl-
CAS No:142383-74-2
MF:C8H6ClNOS
MW:199.657339572906
CID:1316533
Update Time:2024-08-18

1,2-Benzisothiazol-3(2H)-one, 5-chloro-2-methyl- Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzisothiazol-3(2H)-one, 5-chloro-2-methyl-
    • Inchi： 1S/C8H6ClNOS/c1-10-8(11)6-4-5(9)2-3-7(6)12-10/h2-4H,1H3
    • InChI Key： CSSXKNNUSDDBOU-UHFFFAOYSA-N
    • SMILES： S1C2=C(C=C(Cl)C=C2)C(=O)N1C

Computed Properties

  • Exact Mass: 198.98598

Experimental Properties

  • Density: 1.452±0.06 g/cm3(Predicted)
  • Boiling Point: 344.8±44.0 °C(Predicted)
  • PSA: 20.31
  • pka: -2.87±0.20(Predicted)

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