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CS-W001157 4
Total: USD 88.00

2,4-PDCA

  • CAS No. 499-80-9

  • Cat. No. CS-W017848
  • Purity≥97%
  • MDL No.MFCD00006296

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

2,4-PDCA|CS-W017848

Structure of 499-80-9

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General Information

  • CAS No. 499-80-9
  • Cat. No. CS-W017848
  • Purity ≥97%
  • MDL No. MFCD00006296
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₅NO₄
  • Molecular Weight 167.12
  • Synonym(s) None
  • SMILES O=C(C1=NC=CC(C(O)=O)=C1)O

Description

Standard building block for introduction of D-aspartic acid amino-acid residues by Boc SPPS. Associated Protocols and Technical Articles Cleavage and Deprotection Protocols for Boc SPPS

Synthesis

  • Route1
    • null|null
      108-47-4
    • ~50%
    • In-stock
      2,4-PDCA|CS-W017848
      499-80-9

    References

    • Iovel', I. G.; Gol'dberg, Yu. Sh.; Gaukhman, A. P.; Zolotoyabko, R. M.; Shimanskaya, M. V. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1991 , vol. 27, # 7 p. 768 - 771 Khimiya Geterotsiklicheskikh Soedinenii, 1991 , # 7 p. 959 - 962
  • Route2
    • 4-Cyanopicolinamide|CS-1140283
      54089-05-3
    • ~%
    • In-stock
      2,4-PDCA|CS-W017848
      499-80-9

    References

    • Lonza Ltd. Patent: US5614636 A1, 1997 ;
  • Route3
    • null|null
      2150-18-7
    • ~%
    • In-stock
      2,4-PDCA|CS-W017848
      499-80-9

    References

    • Eckert; Loria Monatshefte fuer Chemie, 1917 , vol. 38, p. 239

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   87.49
  • LogP   0.478
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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