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Ethyl 5-chloro-2-nitrobenzoate

  • CAS No. 51282-56-5

  • Cat. No. CS-0307959
  • Molecule weight229.62
  • Purity95+%
  • MDL No.None

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

Ethyl 5-chloro-2-nitrobenzoate|CS-0307959

Structure of 51282-56-5

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General Information

  • CAS No. 51282-56-5
  • Cat. No. CS-0307959
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈ClNO₄
  • Molecular Weight 229.62
  • Synonym(s) 5-Chloro-2-nitro-benzoic acid ethyl ester
  • SMILES CCOC(=O)C1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Synthesis

  • Route1

    References

    • KIRIN BEER KABUSHIKI KAISHA Patent: EP1614676 A1, 2006 ; Location in patent: Page/Page column 176; 178 ; EP 1614676 A1
  • Route2
    • null|null
      64-17-5
    • null|null
      41994-44-9
    • ~%
    • Ethyl 5-chloro-2-nitrobenzoate|CS-0307959
      51282-56-5

    References

    • Japan Tobacco Inc. Patent: EP1479666 A1, 2004 ; Location in patent: Page 184-185 ;

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   69.44
  • LogP   2.4249
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   3

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