Chem
J-GLOBAL ID:200907025592095680   Nikkaji number:J1.124.219G

2,4-Dimethylbenzenesulfonic acid 3-oxo-1,2-benziodoxole-1(3H)-yl ester

2,4-ジメチルベンゼンスルホン酸3-オキソ-1,2-ベンゾヨードキソール-1(3H)-イル
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: C15H13IO5S
Molecular formula furigana: C15-H13-I-O5-S
Molecular weight: 432.230
InChI: InChI=1S/C15H13IO5S/c1-10-7-8-14(11(2)9-10)22(18,19)21-16-13-6-4-3-5-12(13)15(17)20-16/h3-9H,1-2H3
InChI key: IVFIHXMETOBWCB-UHFFFAOYSA-N
SMILES: Cc1ccc(c(C)c1)S(=O)(=O)O[I]1OC(=O)c2ccccc12
Systematic name  (3):
  • 2,4-ジメチルベンゼンスルホン酸3-オキソ-1,2-ベンゾヨードキソール-1(3H)-イル
  • 3-オキソ-3H-1λ3,2-ベンゾヨーダオキソール-1-イル 2,4-ジメチルベンゼン-1-スルホナート
  • 3-oxo-3H-1λ3,2-benziodaoxol-1-yl 2,4-dimethylbenzene-1-sulfonate
Other name (1):
  • 2,4-Dimethylbenzenesulfonic acid 3-oxo-1,2-benziodoxole-1(3H)-yl ester
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