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CS-W001157 4
Total: USD 88.00

5-Nitro-4(3H)-quinazolinone

  • CAS No. 99768-67-9

  • Cat. No. CS-0039188
  • Purity≥97%
  • MDL No.MFCD12198902

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

5-Nitro-4(3H)-quinazolinone|CS-0039188

Structure of 99768-67-9

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General Information

  • CAS No. 99768-67-9
  • Cat. No. CS-0039188
  • Purity ≥97%
  • MDL No. MFCD12198902
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅N₃O₃
  • Molecular Weight 191.14
  • Synonym(s) 5-Nitro-4-hydroxyquinazoline
  • SMILES O=C1NC=NC2=C1C([N+]([O-])=O)=CC=C2

Synthesis

  • Route1
    • null|null
      77287-34-4
    • ~%
    • In-stock
      5-Nitro-4(3H)-quinazolinone|CS-0039188
      99768-67-9

    References

    • Journal of the American Chemical Society, , vol. 27, p. 653
  • Route2

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 20, # 11 p. 3235 - 3239

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   88.89
  • LogP   0.8313
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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