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CS-W001157 4
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2-Bromo-1-(3,5-dimethoxyphenyl)ethan-1-one

  • CAS No. 50841-50-4

  • Cat. No. CS-0223953
  • Purity≥98%
  • MDL No.None

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

2-Bromo-1-(3,5-dimethoxyphenyl)ethan-1-one|CS-0223953

Structure of 50841-50-4

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General Information

  • CAS No. 50841-50-4
  • Cat. No. CS-0223953
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁BrO₃
  • Molecular Weight 259.10
  • Synonym(s) 2-Bromo-1-(3,5-dimethoxyphenyl)ethanone
  • SMILES COC1=CC(=CC(=C1)C(=O)CBr)OC

Synthesis

  • Route1

    References

    • Kim, Ikyon; Choi, Jihyun Organic and Biomolecular Chemistry, 2009 , vol. 7, # 13 p. 2788 - 2795
  • Route2

    References

    • Chen, Li; Ding, Qingjie; Gillespie, Paul; Kim, Kyungjin; Lovey, Allen John; McComas, Warren William; Mullin JR., John Guilfoye; Perrotta, Agostino Patent: US2002/151554 A1, 2002 ;
  • Route3

    References

    • Abe et al. Yakugaku Zasshi, 1956 , vol. 76, p. 1094 Chem.Abstr., 1957 , p. 2636

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 1759
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H315-H318-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   35.53
  • LogP   2.2814
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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