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CS-W001157 4
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2-Chloro-1-methoxy-3-nitrobenzene

  • CAS No. 3970-39-6

  • Cat. No. CS-B0021
  • Purity≥97%
  • MDL No.MFCD11035883

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

2-Chloro-1-methoxy-3-nitrobenzene|CS-B0021

Structure of 3970-39-6

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General Information

  • CAS No. 3970-39-6
  • Cat. No. CS-B0021
  • Purity ≥97%
  • MDL No. MFCD11035883
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆ClNO₃
  • Molecular Weight 187.58
  • Synonym(s) 2-Chloro-3-nitroanisole
  • SMILES COC1=CC=CC([N+]([O-])=O)=C1Cl

Synthesis

  • Route1
    • In-stock
      2-Chloro-3-nitrophenol|CS-B0020
      603-84-9
    • null|null
      74-88-4
    • ~98%
    • In-stock
      2-Chloro-1-methoxy-3-nitrobenzene|CS-B0021
      3970-39-6

    References

    • Boehringer Ingelheim International GmbH Patent: US2006/19905 A1, 2006 ; Location in patent: Page/Page column 25 ; US 20060019905 A1
  • Route2

    References

    • Gerspacher, Marc; Altmann, Eva; Beerli, Rene; Buhl, Thomas; Endres, Ralf; Gamse, Rainer; Kameni-Tcheudji, Jacques; Kneissel, Michaela; Krawinkler, Karl Heinz; Missbach, Martin; Schmidt, Alfred; Seuwen, Klaus; Weiler, Sven; Widler, Leo Bioorganic and Medicinal Chemistry Letters, 2010 , vol. 20, # 17 p. 5161 - 5164
  • Route3

    References

    • Adams; Finger Journal of the American Chemical Society, 1939 , vol. 61, p. 2828

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   52.37
  • LogP   2.2568
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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