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CS-W001157 4
Total: USD 88.00

6-Chloro-2-methyl-5-nitropyrimidin-4(3H)-one

  • CAS No. 82779-50-8

  • Cat. No. CS-0571782
  • Molecule weight189.56
  • Purity≥98%
  • MDL No.None

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

6-Chloro-2-methyl-5-nitropyrimidin-4(3H)-one|CS-0571782

Structure of 82779-50-8

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General Information

  • CAS No. 82779-50-8
  • Cat. No. CS-0571782
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₄ClN₃O₃
  • Molecular Weight 189.56
  • Synonym(s) 2-Methyl-6-chloro-5-nitro-4(1H)-pyrimidinone
  • SMILES CC1=NC(=C(C(=O)N1)[N+](=O)[O-])Cl

Synthesis

  • Route1

    References

    • Beck, James P.; Arvanitis, Argyrios G.; Curry, Matt A.; Rescinito, Joseph T.; Fitzgerald, Larry W.; Gilligan, Paul J.; Zaczek, Robert; Trainor, George L. Bioorganic and Medicinal Chemistry Letters, 1999 , vol. 9, # 7 p. 967 - 972
  • Route2

    References

    • Beck, James P.; Arvanitis, Argyrios G.; Curry, Matt A.; Rescinito, Joseph T.; Fitzgerald, Larry W.; Gilligan, Paul J.; Zaczek, Robert; Trainor, George L. Bioorganic and Medicinal Chemistry Letters, 1999 , vol. 9, # 7 p. 967 - 972

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   88.89
  • LogP   0.63992
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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