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CS-W001157 4
Total: USD 88.00

3-Bromo-5-nitroquinoline

  • CAS No. 116632-33-8

  • Cat. No. CS-0094245
  • Purity≥95%
  • MDL No.MFCD25956079

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

3-Bromo-5-nitroquinoline|CS-0094245

Structure of 116632-33-8

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General Information

  • CAS No. 116632-33-8
  • Cat. No. CS-0094245
  • Purity ≥95%
  • MDL No. MFCD25956079
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₅BrN₂O₂
  • Molecular Weight 253.05
  • Synonym(s) Pyridine,3-bromo-5-nitro
  • SMILES O=[N+](C1=C2C=C(Br)C=NC2=CC=C1)[O-]

Synthesis

  • Route1

    References

    • Claus; Decker Journal fuer Praktische Chemie (Leipzig), 1889 , vol. <2> 39, p. 301 Full Text Show Details Claus; Setzer Journal fuer Praktische Chemie (Leipzig), 1896 , vol. <2> 53, p. 392 Full Text Show Details Decker Chemische Berichte, 1905 , vol. 38, p. 1279 Full Text Show Details Claus; Howitz Journal fuer Praktische Chemie (Leipzig), 1893 , vol. <2> 48, p. 158 Journal fuer Praktische Chemie (Leipzig), 1894 , vol. <2> 50, p. 239
  • Route2

    References

    • Porter, John; Lumb, Simon; Lecomte, Fabien; Reuberson, James; Foley, Anne; Calmiano, Mark; le Riche, Kelly; Edwards, Helen; Delgado, Jean; Franklin, Richard J.; Gascon-Simorte, Jose M.; Maloney, Alison; Meier, Christoph; Batchelor, Mark Bioorganic and Medicinal Chemistry Letters, 2009 , vol. 19, # 2 p. 397 - 400
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    References

    • Sarkar, Parantap; Jeon, Ie-Rang; Durola, Fabien; Bock, Harald New Journal of Chemistry, 2012 , vol. 36, # 3 p. 570 - 574

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

Quality Control

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Computational Chemistry Data

  • TPSA   56.03
  • LogP   2.9055
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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