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CS-W001157 4
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2H-Benzo[e][1,2]thiazin-4(3H)-one 1,1-dioxide

  • CAS No. 5510-09-8

  • Cat. No. CS-0092024
  • Molecule weight197.21
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

2H-Benzo[e][1,2]thiazin-4(3H)-one 1,1-dioxide|CS-0092024

Structure of 5510-09-8

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General Information

  • CAS No. 5510-09-8
  • Cat. No. CS-0092024
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₇NO₃S
  • Molecular Weight 197.21
  • Synonym(s) 4-methyl-1-naphthalen-1-ylsulfonylpiperidine
  • SMILES O=S(C1=CC=CC=C1C2=O)(NC2)=O

Synthesis

  • Route1
    • Methyl 4-hydroxy-2H-benzo[e][1,2]thiazine-3-carboxylate 1,1-dioxide|CS-0084726
      35511-14-9
    • ~68%
    • 2H-Benzo[e][1,2]thiazin-4(3H)-one 1,1-dioxide|CS-0092024
      5510-09-8

    References

    • Chen, Xin; Zhang, Shuzhen; Yang, Yanchun; Hussain, Saghir; He, Minlan; Gui, Dequan; Ma, Bing; Jing, Chaojun; Qiao, Zhixin; Zhu, Changjin; Yu, Qun Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 23 p. 7262 - 7269
  • Route2
    • Methyl 2-(1,1-dioxido-3-oxobenzo[d]isothiazol-2(3h)-yl)acetate|CS-0302107
      6639-62-9
    • ~%
    • 2H-Benzo[e][1,2]thiazin-4(3H)-one 1,1-dioxide|CS-0092024
      5510-09-8

    References

    • Schapira, Celia B.; Perillo, Isabel A.; Lamdan, Samuel Journal of Heterocyclic Chemistry, 1980 , vol. 17, p. 1281 - 1288
  • Route3

    References

    • Schapira, Celia B.; Perillo, Isabel A.; Lamdan, Samuel Journal of Heterocyclic Chemistry, 1980 , vol. 17, p. 1281 - 1288

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   63.24
  • LogP   0.1612
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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