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CS-W001157 4
Total: USD 88.00

4-Acetamido-3-bromobenzoic acid

  • CAS No. 74103-28-9

  • Cat. No. CS-0360245
  • Purity95+%
  • MDL No.None

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

4-Acetamido-3-bromobenzoic acid|CS-0360245

Structure of 74103-28-9

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General Information

  • CAS No. 74103-28-9
  • Cat. No. CS-0360245
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈BrNO₃
  • Molecular Weight 258.07
  • Synonym(s) 4-(Acetylamino)-3-bromobenzoic acid
  • SMILES CC(NC1=C(Br)C=C(C(O)=O)C=C1)=O

Synthesis

  • Route1

    References

    • Shcherbina, F. F.; Tmenov, D. N.; Lysukho, T. V.; Belous, N. P. Journal of Organic Chemistry USSR (English Translation), 1980 , vol. 16, p. 340 - 342 Zhurnal Organicheskoi Khimii, 1980 , vol. 16, # 2 p. 381 - 384
  • Route2

    References

    • Koo, Bon-Suk; Kim, Eun-Hoo; Lee, Kee-Jung Synthetic Communications, 2002 , vol. 32, # 15 p. 2275 - 2286
  • Route3
    • N-(4-Acetyl-2-bromophenyl)acetamide|CS-0128933
      101209-08-9
    • ~%
    • 4-Acetamido-3-bromobenzoic acid|CS-0360245
      74103-28-9

    References

    • Raiford; Davis Journal of the American Chemical Society, 1928 , vol. 50, p. 160

Safety Information

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GHS Pictogram : N/A
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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   66.4
  • LogP   2.1057
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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