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CS-W001157 4
Total: USD 88.00

Ethyl 3-bromo-5-nitrobenzoate

  • CAS No. 690260-94-7

  • Cat. No. CS-0151783
  • Molecule weight274.07
  • Purity≥98%
  • MDL No.MFCD09258760

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

Ethyl 3-bromo-5-nitrobenzoate|CS-0151783

Structure of 690260-94-7

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General Information

  • CAS No. 690260-94-7
  • Cat. No. CS-0151783
  • Purity ≥98%
  • MDL No. MFCD09258760
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈BrNO₄
  • Molecular Weight 274.07
  • Synonym(s) Benzoic acid, 3-bromo-5-nitro-, ethyl ester
  • SMILES CCOC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])Br

Synthesis

  • Route1
    • null|null
      64-17-5
    • null|null
      51339-40-3
    • ~80%
    • In-stock
      Ethyl 3-bromo-5-nitrobenzoate|CS-0151783
      690260-94-7

    References

    • GLAXO GROUP LIMITED Patent: WO2004/39753 A2, 2004 ; Location in patent: Page 60 ; WO 2004/039753 A2
  • Route2
    • null|null
      64-17-5
    • In-stock
      3-Bromo-5-nitrobenzoic acid|CS-W002370
      6307-83-1
    • ~%
    • In-stock
      Ethyl 3-bromo-5-nitrobenzoate|CS-0151783
      690260-94-7

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 21, # 13 p. 3992 - 3996
  • Route3

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 21, # 13 p. 3992 - 3996

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   69.44
  • LogP   2.534
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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