Chem
J-GLOBAL ID：200907030704863922   Nikkaji number：J206.952K

2-(2-Hydroxyethyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide

2-(2-ヒドロキシエチル)-1,2-ベンゾイソチアゾール-3(2H)-オン1,1-ジオキシド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C9H9NO2[O-]2[S+2]
Molecular formula furigana： C9-H9-N-O4-S
Molecular weight： 227.230
InChI： InChI=1S/C9H9NO4S/c11-6-5-10-9(12)7-3-1-2-4-8(7)15(10,13)14/h1-4,11H,5-6H2
InChI key： CJWAPCSQEWUZAE-UHFFFAOYSA-N
SMILES： OCCN1C(=O)c2ccccc2[S+2]1([O-])[O-]
Systematic name  (3)：
  • 2-(2-ヒドロキシエチル)-1,2-ベンゾイソチアゾール-3(2H)-オン1,1-ジオキシド
  • 2-(2-ヒドロキシエチル)-3-オキソ-2,3-ジヒドロ-1H-1,2-ベンゾチアゾール-1,1-ジイウム-1,1-ビス(オラート)
  • 2-(2-hydroxyethyl)-3-oxo-2,3-dihydro-1H-1,2-benzothiazole-1,1-diium-1,1-bis(olate)
Other name (1)：
  • 2-(2-Hydroxyethyl)-1,2-benzisothiazol-3(2H)-one 1,1-dioxide
CAS registry number： 6343-81-3
Regulation number (1)：
  • EINECS2287438
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