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Tert-butyl n-[1-(2-chloropyrimidin-4-yl)piperidin-4-yl]carbamate

  • CAS No. 596817-49-1

  • Cat. No. CS-0259626
  • Molecule weight312.80
  • Purity≥97%
  • MDL No.MFCD09028512

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

Tert-butyl n-[1-(2-chloropyrimidin-4-yl)piperidin-4-yl]carbamate|CS-0259626

Structure of 596817-49-1

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General Information

  • CAS No. 596817-49-1
  • Cat. No. CS-0259626
  • Purity ≥97%
  • MDL No. MFCD09028512
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₁ClN₄O₂
  • Molecular Weight 312.80
  • Synonym(s) tert-Butyl (1-(2-chloropyrimidin-4-yl)piperidin-4-yl)carbamate
  • SMILES CC(C)(OC(NC1CCN(C2=NC(Cl)=NC=C2)CC1)=O)C

Synthesis

  • Route1
    • null|null
      3934-20-1
    • In-stock
      4-Boc-Aminopiperidine|CS-D0638
      73874-95-0
    • ~53%
    • In-stock
      Tert-butyl n-[1-(2-chloropyrimidin-4-yl)piperidin-4-yl]carbamate|CS-0259626
      596817-49-1

    References

    • ALMAC DISCOVERY LIMITED; HARRISON, Timothy; BURKAMP, Frank; JORDAN, Linda; BELL, Mark; JANSSEN, Dominic; MIEL, Hugues; MCFARLAND, Mary Patent: WO2012/69852 A1, 2012 ; Location in patent: Page/Page column 60 ;

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-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   67.35
  • LogP   2.6235
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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