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CS-W001157 4
Total: USD 88.00

1-(3-Bromo-4-methoxyphenyl)-2-chloroethan-1-one

  • CAS No. 3114-09-8

  • Cat. No. CS-0222615
  • Purity≥98%
  • MDL No.None

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

1-(3-Bromo-4-methoxyphenyl)-2-chloroethan-1-one|CS-0222615

Structure of 3114-09-8

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General Information

  • CAS No. 3114-09-8
  • Cat. No. CS-0222615
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₈BrClO₂
  • Molecular Weight 263.52
  • Synonym(s) 1-(3-Bromo-4-methoxyphenyl)-2-chloroethanone
  • SMILES O=C(C1=CC=C(OC)C(Br)=C1)CCl

Synthesis

  • Route1

    References

    • Beaulieu, Francis; Marinier, Anne; Ouellet, Carl; Roy, Stephan; Wittman, Mark D. Patent: US2005/54655 A1, 2005 ; Location in patent: Page/Page column 12 ; US 20050054655 A1
  • Route2

    References

    • Iradyan, M. A.; Aroyan, R. A.; Engoyan, A. P.; Grigoryan, G. Kh.; Nersesyan, S. E.; Panosyan, A. G. Pharmaceutical Chemistry Journal, 1994 , vol. 28, # 7 p. 455 - 458 Khimiko-Farmatsevticheskii Zhurnal, 1994 , vol. 28, # 7 p. 13 - 15
  • Route3

    References

    • Hasegawa, Masakazu; Yamada, Koji; Nagahama, Yoshiyuki; Somei, Masanori Heterocycles, 1999 , vol. 51, # 12 p. 2815 - 2821

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

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.8792
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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