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CS-W001157 4
Total: USD 88.00

2-Chloro-N-methyl-6-nitroaniline

  • CAS No. 75438-12-9

  • Cat. No. CS-0112741
  • Molecule weight186.60
  • Purity≥98%
  • MDL No.None

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

2-Chloro-N-methyl-6-nitroaniline|CS-0112741

Structure of 75438-12-9

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General Information

  • CAS No. 75438-12-9
  • Cat. No. CS-0112741
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇ClN₂O₂
  • Molecular Weight 186.60
  • Synonym(s) N-methyl-2-chloro-6-nitroaniline
  • SMILES O=[N+](C1=C(C(Cl)=CC=C1)NC)[O-]

Synthesis

  • Route1
    • null|null
      3209-22-1
    • null|null
      74-89-5
    • ~63%
    • 2-Chloro-N-methyl-6-nitroaniline|CS-0112741
      75438-12-9

    References

    • Pytela, Oldrich; Kulhanek, Jiri; Jiraskova, Eva; Nevecna, Tatjana Collection of Czechoslovak Chemical Communications, 2001 , vol. 66, # 11 p. 1638 - 1658
  • Route2
    • null|null
      74-89-5
    • ~%
    • 2-Chloro-N-methyl-6-nitroaniline|CS-0112741
      75438-12-9

    References

    • Fader, Lee D.; Bethell, Richard; Bonneau, Pierre; Boes, Michael; Bousquet, Yves; Cordingley, Michael G.; Coulombe, Rene; Deroy, Patrick; Faucher, Anne-Marie; Gagnon, Alexandre; Goudreau, Nathalie; Grand-Maitre, Chantal; Guse, Ingrid; Hucke, Oliver; Kawai, Stephen H.; Lacoste, Jean-Eric; Landry, Serge; Lemke, Christopher T.; Malenfant, Eric; Mason, Stephen; Morin, Sebastien; O'Meara, Jeff; Simoneau, Bruno; Titolo, Steve; Yoakim, Christiane Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 1 p. 398 - 404
  • Route3

    References

    • Hayes, Martin E.; Wallace, Grier A.; Grongsaard, Pintipa; Bischoff, Agnieszka; George, Dawn M.; Miao, Wenyan; McPherson, Michael J.; Stoffel, Robert H.; Green, David W.; Roth, Gregory P. Bioorganic and Medicinal Chemistry Letters, 2008 , vol. 18, # 5 p. 1573 - 1576

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

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Computational Chemistry Data

  • TPSA   55.17
  • LogP   2.2899
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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