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CS-W001157 4
Total: USD 88.00

4-Bromo-2-phenylaniline

  • CAS No. 5455-13-0

  • Cat. No. CS-0191829
  • Purity≥98%
  • MDL No.None

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

4-Bromo-2-phenylaniline|CS-0191829

Structure of 5455-13-0

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General Information

  • CAS No. 5455-13-0
  • Cat. No. CS-0191829
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₀BrN
  • Molecular Weight 248.12
  • Synonym(s) 5-Bromobiphenyl-2-amine
  • SMILES C1=CC=C(C=C1)C2=C(C=CC(=C2)Br)N

Synthesis

  • Route1
    • N-(5-Bromo-[1,1'-biphenyl]-2-yl)acetamide|CS-0878011
      7147-52-6
    • ~%
    • 4-Bromo-2-phenylaniline|CS-0191829
      5455-13-0

    References

    • Scarborough; Waters Journal of the Chemical Society, 1927 , p. 94
  • Route2
    • null|null
      90-41-5
    • ~67%
    • 4-Bromo-2-phenylaniline|CS-0191829
      5455-13-0

    References

    • Golling, Florian E.; Quernheim, Martin; Wagner, Manfred; Nishiuchi, Tomohiko; Muellen, Klaus Angewandte Chemie - International Edition, 2014 , vol. 53, # 6 p. 1525 - 1528 Angew. Chem., 2014 , vol. 126, # 6 p. 1551 - 1554,4
  • Route3

    References

    • CALDERWOOD, DAVID; ARNOLD, LEE; MAZDIYASNI, HORMOZ; HIRST, GAVIN C.; DENG, BOJUAN B.; JOHNSTON, DAVID N.; RAFFERTY, PAUL; TOMETZKI, GERALD B.; TWIGGER, HELEN L.; MUNSCHAUER, RAINER Patent: US2003/187001 A1, 2003 ; US 20030187001 A1

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
Precautionary Statements : P264-P280-P302+P352-P362+P364

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   3.6983
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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