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CS-W001157 4
Total: USD 88.00

2-((tert-Butoxycarbonyl)amino)-2-(pyridin-3-yl)acetic acid

  • CAS No. 347187-29-5

  • Cat. No. CS-0310597
  • Molecule weight252.27
  • Purity≥98%
  • MDL No.None

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

2-((tert-Butoxycarbonyl)amino)-2-(pyridin-3-yl)acetic acid|CS-0310597

Structure of 347187-29-5

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General Information

  • CAS No. 347187-29-5
  • Cat. No. CS-0310597
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₆N₂O₄
  • Molecular Weight 252.27
  • Synonym(s) 2-(Boc-amino)-2-(3-pyridinyl)acetic acid
  • SMILES O=C(NC(C1=CC=CN=C1)C(O)=O)OC(C)(C)C

Synthesis

  • Route1
    • Ethyl 2-((tert-butoxycarbonyl)amino)-2-(pyridin-3-yl)acetate|CS-0753058
      313490-93-6
    • ~%
    • 2-((tert-Butoxycarbonyl)amino)-2-(pyridin-3-yl)acetic acid|CS-0310597
      347187-29-5

    References

    • Baruah, Pranjal K.; Dinsmore, Jason; King, Amber M.; Salome, Christophe; De Ryck, Marc; Kaminski, Rafal; Provins, Laurent; Kohn, Harold Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 11 p. 3551 - 3564
  • Route2

    References

    • Baruah, Pranjal K.; Dinsmore, Jason; King, Amber M.; Salome, Christophe; De Ryck, Marc; Kaminski, Rafal; Provins, Laurent; Kohn, Harold Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 11 p. 3551 - 3564
  • Route3
    • 3-Pyridylacetic acid hydrochloride Risedronate  Impurity|CS-0229121
      6419-36-9
    • ~%
    • 2-((tert-Butoxycarbonyl)amino)-2-(pyridin-3-yl)acetic acid|CS-0310597
      347187-29-5

    References

    • Baruah, Pranjal K.; Dinsmore, Jason; King, Amber M.; Salome, Christophe; De Ryck, Marc; Kaminski, Rafal; Provins, Laurent; Kohn, Harold Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 11 p. 3551 - 3564

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-H320-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   88.52
  • LogP   1.732
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   3

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