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CS-W001157 4
Total: USD 88.00

2-(Morpholinothio)benzothiazole

  • CAS No. 102-77-2

  • Cat. No. CS-0201154
  • Purity≥95%
  • MDL No.MFCD00022870

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

2-(Morpholinothio)benzothiazole|CS-0201154

Structure of 102-77-2

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General Information

  • CAS No. 102-77-2
  • Cat. No. CS-0201154
  • Purity ≥95%
  • MDL No. MFCD00022870
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₂N₂OS₂
  • Molecular Weight 252.36
  • Synonym(s) None
  • SMILES C1(SN2CCOCC2)=NC3=CC=CC=C3S1

Description

2-(Morpholinothio)benzothiazole features a morpholinothio group attached to the benzothiazole core, delivering enhanced solubility and electron-rich character. This structural motif enables efficient coupling in transition-metal-catalyzed transformations and serves as a robust scaffold for bioactive compound synthesis.

Application

2-(Morpholinothio)benzothiazole serves as a versatile building block for sulfur-containing heterocycles, enabling efficient access to benzothiazole-based scaffolds through palladium-catalyzed cross-coupling and nucleophilic substitution reactions. Its morpholinothio group enhances solubility and functional group tolerance, facilitating purification and integration into complex molecular architectures relevant to medicinal chemistry and materials science.

Synthesis

  • Route1
    • null|null
      110-91-8
    • null|null
      120-78-5
    • ~97%
    • In-stock
      2-(Morpholinothio)benzothiazole|CS-0201154
      102-77-2

    References

    • Bayer Aktiengesellschaft Patent: US4751301 A1, 1988 ;
  • Route2

    References

    • EP314663 A1, ;
  • Route3
    • null|null
      110-91-8
    • In-stock
      2-Mercaptobenzothiazole|CS-W017829
      149-30-4
    • ~95%
    • In-stock
      2-(Morpholinothio)benzothiazole|CS-0201154
      102-77-2

    References

    • Ramadas, Krishnamurthy; Srinivasan, Natarajan Synthetic Communications, 1996 , vol. 26, # 22 p. 4179 - 4184

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08,GHS09
Signal Word : Danger
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H315-H317-H319-H372-H411
Precautionary Statements : P260-P261-P264-P270-P272-P273-P280-P302+P352-P330-P362+P364-P391-P501

Quality Control

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Computational Chemistry Data

  • TPSA   25.36
  • LogP   2.6356
  • H_Acceptors   5
  • H_Donors   0
  • Rotatable_Bonds   2

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