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CS-W001157 4
Total: USD 88.00

4-Aminotetrahydro-2H-thiopyran-4-carbonitrile

  • CAS No. 50289-20-8

  • Cat. No. CS-0102101
  • Purity≥95%
  • MDL No.MFCD09607997

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

4-Aminotetrahydro-2H-thiopyran-4-carbonitrile|CS-0102101

Structure of 50289-20-8

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General Information

  • CAS No. 50289-20-8
  • Cat. No. CS-0102101
  • Purity ≥95%
  • MDL No. MFCD09607997
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₁₀N₂S
  • Molecular Weight 142.22
  • Synonym(s) 4-Aminotetrahydrothiopyran-4-carbonitrile
  • SMILES N#CC1(CCSCC1)N

Synthesis

  • Route1
    • In-stock
      Tetrahydrothiopyran-4-one|CS-W002007
      1072-72-6
    • null|null
      151-50-8
    • ~90%
    • In-stock
      4-Aminotetrahydro-2H-thiopyran-4-carbonitrile|CS-0102101
      50289-20-8

    References

    • MITSUBISHI TANABE PHARMA CORPORATION Patent: WO2008/4698 A2, 2008 ; Location in patent: Page/Page column 125 ;
  • Route2

    References

    • E. I. Du Pont de Nemours and Company Patent: US5512681 A1, 1996 ; US 5512681 A
  • Route3
    • In-stock
      Tetrahydrothiopyran-4-one|CS-W002007
      1072-72-6
    • null|null
      7677-24-9
    • ~%
    • In-stock
      4-Aminotetrahydro-2H-thiopyran-4-carbonitrile|CS-0102101
      50289-20-8

    References

    • MERCK SHARP and DOHME CORP.; ALTMAN, Michael, D.; BIENSTOCK, Corey, E.; BUTCHER, John, W.; CHILDERS, Kaleen Konrad; DI FRANCESCO, Maria Emilia; DONOFRIO, Anthony; ELLIS, John Michael; FISCHER, Christian; HAIDLE, Andrew, M.; JEWELL, James, P.; KNOWLES, Sandra Lee; NORTHRUP, Alan, B.; OTTE, Ryan, D.; PETERSON, Scott, L.; SMITH, Graham Frank Patent: WO2013/52394 A1, 2013 ; Location in patent: Paragraph 00282 ;

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   49.81
  • LogP   0.73448
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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