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CS-W001157 4
Total: USD 88.00

6-Chlorouracil

  • CAS No. 4270-27-3

  • Cat. No. CS-B0829
  • Purity≥98%
  • MDL No.MFCD00014595

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

6-Chlorouracil|CS-B0829

Structure of 4270-27-3

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General Information

  • CAS No. 4270-27-3
  • Cat. No. CS-B0829
  • Purity ≥98%
  • MDL No. MFCD00014595
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₃ClN₂O₂
  • Molecular Weight 146.53
  • Synonym(s) NSC 210419; NSC 43265; 6-chloropyrimidine-2,4(1H,3H)-dione; 6-Chlorouracil
  • SMILES ClC(NC(N1)=O)=CC1=O

Description

Crystal violet may be used as a reference standard in the analysis of crystal violet in salmon fish and in water samples using liquid chromatography coupled with tandem mass spectrometry (LC-MS-MS) and magnetic solid phase extraction using magneticaffinity adsorbent, respectively.

Application

6-Chlorouracil serves as a key building block in nucleoside and heterocyclic synthesis, enabling direct functionalization at the C6 position. Its well-established reactivity facilitates efficient substitution reactions, including palladium-catalyzed couplings and nucleophilic displacement, making it valuable for constructing bioactive scaffolds. The compound exhibits good bench stability and is readily purified by recrystallization, supporting reliable use in medicinal chemistry and process development workflows.

Synthesis

  • Route1

    References

    • Raoof, Ali; Depledge, Paul; Hamilton, Niall M.; Hamilton, Nicola S.; Hitchin, James R.; Hopkins, Gemma V.; Jordan, Allan M.; Maguire, Laura A.; McGonagle, Alison E.; Mould, Daniel P.; Rushbrooke, Mathew; Small, Helen F.; Smith, Kate M.; Thomson, Graeme J.; Turlais, Fabrice; Waddell, Ian D.; Waszkowycz, Bohdan; Watson, Amanda J.; Ogilvie, Donald J. Journal of Medicinal Chemistry, 2013 , vol. 56, # 16 p. 6352 - 6370
  • Route2

    References

    • Iwata, Masaki; Bruice, Thomas C.; Carrell, H. L.; Glusker, Jenny P, Journal of the American Chemical Society, 1980 , vol. 102, # 15 p. 5036 - 5044
  • Route3
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    • In-stock
      6-Chlorouracil|CS-B0829
      4270-27-3

    References

    • Todorovic, Nick; Giacomelli, Andrew; Hassell, John A.; Frampton, Christopher S.; Capretta, Alfredo Tetrahedron Letters, 2010 , vol. 51, # 46 p. 6037 - 6040

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   65.72
  • LogP   -0.2834
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   0

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