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CS-W001157 4
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4-Chloro-1-(4-methoxyphenyl)butan-1-one

  • CAS No. 40877-19-8

  • Cat. No. CS-0317865
  • Molecule weight212.67
  • Purity95+%
  • MDL No.MFCD00018995

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

4-Chloro-1-(4-methoxyphenyl)butan-1-one|CS-0317865

Structure of 40877-19-8

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General Information

  • CAS No. 40877-19-8
  • Cat. No. CS-0317865
  • Purity 95+%
  • MDL No. MFCD00018995
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₃ClO₂
  • Molecular Weight 212.67
  • Synonym(s) gamma-Chloro-4-methoxybutyrophenone
  • SMILES COC1=CC=C(C=C1)C(=O)CCCCl

Synthesis

  • Route1
    • null|null
      100-66-3
    • null|null
      4635-59-0
    • ~95%
    • In-stock
      4-Chloro-1-(4-methoxyphenyl)butan-1-one|CS-0317865
      40877-19-8

    References

    • F.HOFFMANN-LA ROCHE AG Patent: WO2006/32453 A1, 2006 ; Location in patent: Page/Page column 20-21 ; WO 2006/032453 A1
  • Route2
    • null|null
      33397-21-6
    • null|null
      4635-59-0
    • ~66%
    • In-stock
      4-Chloro-1-(4-methoxyphenyl)butan-1-one|CS-0317865
      40877-19-8

    References

    • Rao, Maddali L.N.; Venkatesh, Varadhachari; Banerjee, Debasis Tetrahedron, 2007 , vol. 63, # 52 p. 12917 - 12926
  • Route3
    • In-stock
      4-Chloro-N-methoxy-N-methylbutanamide|CS-0046358
      64214-66-0
    • null|null
      13139-86-1
    • ~%
    • In-stock
      4-Chloro-1-(4-methoxyphenyl)butan-1-one|CS-0317865
      40877-19-8

    References

    • Pablo, Oscar; Guijarro, David; Yus, Miguel Journal of Organic Chemistry, 2013 , vol. 78, # 18 p. 9181 - 9189

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS08,GHS09
Signal Word : Warning
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H315-H317-H319-H335-H341-H361-H411
Precautionary Statements : P202-P271-P280-P308+P313-P302+P352-P305+P351+P338-P405-P403+P233-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.8969
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   5

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