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CS-W001157 4
Total: USD 88.00

4-Bromo-2-chloro-N,N-dimethylaniline

  • CAS No. 50638-51-2

  • Cat. No. CS-0195310
  • Molecule weight234.52
  • Purity95+%
  • MDL No.None

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

4-Bromo-2-chloro-N,N-dimethylaniline|CS-0195310

Structure of 50638-51-2

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General Information

  • CAS No. 50638-51-2
  • Cat. No. CS-0195310
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₉BrClN
  • Molecular Weight 234.52
  • Synonym(s) 4-bromanyl-2-chloranyl-N,N-dimethyl-aniline
  • SMILES CN(C)C1=C(C=C(C=C1)Br)Cl

Synthesis

  • Route1

    References

    • Li, James J.; Norton, Monica B.; Reinhard, Emily J.; Anderson, Gary D.; Gregory, Susan A.; Isakson, Peter C.; Koboldt, Carol M.; Masferrer, Jaime L.; Perkins, William E.; Seibert, Karen; Zhang, Yan; Zweifel, Ben S.; Reitz, David B. Journal of Medicinal Chemistry, 1996 , vol. 39, # 9 p. 1846 - 1856
  • Route2

    References

    • G.D. Searle and Co. Patent: US5739166 A1, 1998 ;
  • Route3
    • null|null
      586-77-6
    • ~44%
    • null|null
      366-29-0
    • 4-Bromo-2-chloro-N,N-dimethylaniline|CS-0195310
      50638-51-2

    References

    • Rosevear, Judi; Wilshire, John F. K. Australian Journal of Chemistry, 1980 , vol. 33, # 4 p. 843 - 852

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   3.24
  • LogP   3.1685
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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