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CS-W001157 4
Total: USD 88.00

2-Bromo-1-(pyridin-2-yl)ethan-1-one

  • CAS No. 40086-66-6

  • Cat. No. CS-0452146
  • Purity≥95%
  • MDL No.MFCD06253790

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

2-Bromo-1-(pyridin-2-yl)ethan-1-one|CS-0452146

Structure of 40086-66-6

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General Information

  • CAS No. 40086-66-6
  • Cat. No. CS-0452146
  • Purity ≥95%
  • MDL No. MFCD06253790
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆BrNO
  • Molecular Weight 200.03
  • Synonym(s) 2-bromo-1-pyridin-2-yl-ethanone
  • SMILES C1=CC=NC(=C1)C(=O)CBr

Synthesis

  • Route1
    • 1-(Pyridin-2-yl)ethanone  Imatinib Impurity|CS-0167014
      1122-62-9
    • ~68%
    • In-stock
      2-Bromo-1-(pyridin-2-yl)ethan-1-one|CS-0452146
      40086-66-6

    References

    • Mjambili, Faith; Njoroge, Mathew; Naran, Krupa; De Kock, Carmen; Smith, Peter J.; Mizrahi, Valerie; Warner, Digby; Chibale, Kelly Bioorganic and Medicinal Chemistry Letters, 2014 , vol. 24, # 2 p. 560 - 564
  • Route2
    • null|null
      100-69-6
    • ~37%
    • In-stock
      2-Bromo-1-(pyridin-2-yl)ethan-1-one|CS-0452146
      40086-66-6

    References

    • Nobuta, Tomoya; Hirashima, Shin-Ichi; Tada, Norihiro; Miura, Tsuyoshi; Itoh, Akichika Synlett, 2010 , # 15 p. 2335 - 2339
  • Route3

    References

    • Wunderlich Journal fuer Praktische Chemie (Leipzig), 1955 , vol. <4> 2, p. 302,306

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H290-H314
Precautionary Statements : P234-P260-P264-P280-P301+P330+P331-P304+P340-P363-P390-P405-P406-P501

Quality Control

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Computational Chemistry Data

  • TPSA   29.96
  • LogP   1.6592
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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