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Isothiazole

Chemical compound From Wikipedia, the free encyclopedia

Isothiazole, or 1,2-thiazole, is an organic compound consisting with the formula (CH)3S(N). The ring is unsaturated and features an S-N bond.[4] The isomeric thiazole, where the S and N are not directly bonded are far more common.

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Isothiazole
Full structural formula
Skeletal formula with numbers
Ball-and-stick model
Space-filling model
Names
Preferred IUPAC name
1,2-Thiazole[1]
Other names
isothiazole
Identifiers
3D model (JSmol)
ChEBI
ChemSpider
ECHA InfoCard 100.241.294 Edit this at Wikidata
UNII
  • InChI=1S/C3H3NS/c1-2-4-5-3-1/h1-3H checkY
    Key: ZLTPDFXIESTBQG-UHFFFAOYSA-N checkY
  • InChI=1/C3H3NS/c1-2-4-5-3-1/h1-3H
    Key: ZLTPDFXIESTBQG-UHFFFAOYAS
  • n1sccc1
Properties
C3H3NS
Molar mass 85.12 g·mol−1
Boiling point 114 Â°C (237 Â°F; 387 K)[2]
Acidity (pKa) −0.5 (of conjugate acid)[3]
Related compounds
Related compounds
thiazole, isoxazole
Except where otherwise noted, data are given for materials in their standard state (at 25 Â°C [77 Â°F], 100 kPa).
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Isothiazones are produced by oxidation of enamine-thiones.[5] The ring structure of isothiazole is incorporated into larger compounds with biological activity such as the pharmaceutical drugs ziprasidone and perospirone.

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