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CS-W001157 4
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2-(2-(((Benzhydryloxy)carbonyl)amino)-6-oxo-1H-purin-9(6H)-yl)acetic acid

  • CAS No. 169287-79-0

  • Cat. No. CS-0172744
  • Purity≥95%
  • MDL No.MFCD09261307

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

2-(2-(((Benzhydryloxy)carbonyl)amino)-6-oxo-1H-purin-9(6H)-yl)acetic acid|CS-0172744

Structure of 169287-79-0

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General Information

  • CAS No. 169287-79-0
  • Cat. No. CS-0172744
  • Purity ≥95%
  • MDL No. MFCD09261307
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₂₁H₁₇N₅O₅
  • Molecular Weight 419.39
  • Synonym(s) (2-Benzhydryloxycarbonylamino-6-oxo-1,6-dihydro-purin-9-yl)-acetic acid
  • SMILES OC1=NC(NC(OC(C2=CC=CC=C2)C3=CC=CC=C3)=O)=NC4=C1N=CN4CC(O)=O

Synthesis

  • Route1
    • null|null
      169287-78-9
    • ~85%
    • In-stock
      2-(2-(((Benzhydryloxy)carbonyl)amino)-6-oxo-1H-purin-9(6H)-yl)acetic acid|CS-0172744
      169287-79-0

    References

    • Debaene, Francois; Winssinger, Nicolas Organic Letters, 2003 , vol. 5, # 23 p. 4445 - 4447
  • Route2
    • Diphenylmethanol Diphenhydramine Impurity|CS-0229778
      91-01-0
    • ~%
    • In-stock
      2-(2-(((Benzhydryloxy)carbonyl)amino)-6-oxo-1H-purin-9(6H)-yl)acetic acid|CS-0172744
      169287-79-0

    References

    • Debaene, Francois; Winssinger, Nicolas Organic Letters, 2003 , vol. 5, # 23 p. 4445 - 4447
  • Route3
    • 2-Amino-6-chloropurine Clofarabine Impurity|CS-0229147
      10310-21-1
    • ~%
    • In-stock
      2-(2-(((Benzhydryloxy)carbonyl)amino)-6-oxo-1H-purin-9(6H)-yl)acetic acid|CS-0172744
      169287-79-0

    References

    • Debaene, Francois; Winssinger, Nicolas Organic Letters, 2003 , vol. 5, # 23 p. 4445 - 4447

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   139.46
  • LogP   2.9546
  • H_Acceptors   8
  • H_Donors   3
  • Rotatable_Bonds   6

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