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CS-W001157 4
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3-Bromo-(N1-methyl)benzene-1,2-diamine

  • CAS No. 1150617-55-2

  • Cat. No. CS-0210812
  • Molecule weight201.06
  • Purity≥96%
  • MDL No.MFCD12024390

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

3-Bromo-(N1-methyl)benzene-1,2-diamine|CS-0210812

Structure of 1150617-55-2

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General Information

  • CAS No. 1150617-55-2
  • Cat. No. CS-0210812
  • Purity ≥96%
  • MDL No. MFCD12024390
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₉BrN₂
  • Molecular Weight 201.06
  • Synonym(s) 3-bromo-N1-methylbenzene-1,2-diamine
  • SMILES CNC1=CC=CC(=C1N)Br

Synthesis

  • Route1
    • In-stock
      3-Bromo-N-methyl-2-nitrobenzenamine|CS-0210822
      1150617-53-0
    • ~81%
    • In-stock
      3-Bromo-(N1-methyl)benzene-1,2-diamine|CS-0210812
      1150617-55-2

    References

    • ORTHO-MCNEIL-JANSSEN PHARMACEUTICALS, INC; GIJSEN, Henricus, Jacobus, Maria; BISCHOFF, Francois Paul; ZHUANG, Wei; VAN BRANDT, Sven, Franciscus, Anna; SURKYN, Michel; ZAJA, Mirko; BERTHELOT, Didier, Jean-Claude; DE CLEYN, Michel, Anna, Jozef; MACDONALD, Gregor, James; OEHLRICH, Daniel Patent: WO2010/94647 A1, 2010 ; Location in patent: Page/Page column 64 ; WO 2010/094647 A1
  • Route2

    References

    • Journal of Medicinal Chemistry, , vol. 55, # 21 p. 9089 - 9106,18

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-P405-P501

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Computational Chemistry Data

  • TPSA   38.05
  • LogP   2.073
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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