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CS-W001157 4
Total: USD 88.00

6-Fluoro-3-(piperidin-4-yl)benzo[d]isoxazole

  • CAS No. 84163-77-9

  • Cat. No. CS-0119629
  • Molecule weight220.24
  • Purity≥97%
  • MDL No.MFCD03236724

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

6-Fluoro-3-(piperidin-4-yl)benzo[d]isoxazole|CS-0119629

Structure of 84163-77-9

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General Information

  • CAS No. 84163-77-9
  • Cat. No. CS-0119629
  • Purity ≥97%
  • MDL No. MFCD03236724
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₃FN₂O
  • Molecular Weight 220.24
  • Synonym(s) 6-fluoro-3-(piperidin-4-yl)-1,2-benzoxazole
  • SMILES FC1=CC2=C(C=C1)C(C3CCNCC3)=NO2

Synthesis

  • Route1

    References

    • Jiangsu Guohua Investment Co., Ltd; Shanghai Institute of Pharmaceutical Industry Patent: EP2322520 A1, 2011 ; Location in patent: Page/Page column 16 ;
  • Route2
    • (2,4-Difluorophenyl)(piperidin-4-yl)methanone|CS-0456128
      84162-86-7
    • ~%
    • In-stock
      6-Fluoro-3-(piperidin-4-yl)benzo[d]isoxazole|CS-0119629
      84163-77-9

    References

    • US4804663 A1, ;
  • Route3

    References

    • WO2007/93870 A2, ; Page/Page column 7-9 ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.06
  • LogP   2.4339
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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