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CS-W001157 4
Total: USD 88.00

5-((tert-Butoxycarbonyl)amino)-2-chloroisonicotinic acid

  • CAS No. 171178-46-4

  • Cat. No. CS-W007173
  • Purity≥97%
  • MDL No.MFCD09258838

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

5-((tert-Butoxycarbonyl)amino)-2-chloroisonicotinic acid|CS-W007173

Structure of 171178-46-4

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General Information

  • CAS No. 171178-46-4
  • Cat. No. CS-W007173
  • Purity ≥97%
  • MDL No. MFCD09258838
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃ClN₂O₄
  • Molecular Weight 272.68
  • Synonym(s) 5-BOC-AMINO-2-CHLOROPYRIDINE-4-CARBOXYLIC ACID
  • SMILES O=C(C1=CC(Cl)=NC=C1NC(OC(C)(C)C)=O)O

Synthesis

  • Route1
    • null|null
      124-38-9
    • In-stock
      tert-Butyl (6-chloropyridin-3-yl)carbamate|CS-0036498
      171178-45-3
    • ~68%
    • In-stock
      5-((tert-Butoxycarbonyl)amino)-2-chloroisonicotinic acid|CS-W007173
      171178-46-4

    References

    • WARNER-LAMBERT COMPANY LLC Patent: WO2005/16926 A1, 2005 ; Location in patent: Page/Page column 114-115 ; WO 2005/016926 A1
  • Route2

    References

    • Warner-Lambert Company Patent: US5654307 A1, 1997 ; US 5654307 A
  • Route3
    • null|null
      124-38-9
    • ~%
    • In-stock
      5-((tert-Butoxycarbonyl)amino)-2-chloroisonicotinic acid|CS-W007173
      171178-46-4

    References

    • WO2006/24834 A1, ; Page/Page column 74-75 ; WO 2006/024834 A1

Safety Information

Download SDS
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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   88.52
  • LogP   2.7802
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   2

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