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8-(Benzyloxy)-5-(2-bromoacetyl)quinolin-2(1H)-one

  • CAS No. 100331-89-3

  • Cat. No. CS-0100873
  • Purity≥98%
  • MDL No.MFCD09025318

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

8-(Benzyloxy)-5-(2-bromoacetyl)quinolin-2(1H)-one|CS-0100873

Structure of 100331-89-3

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General Information

  • CAS No. 100331-89-3
  • Cat. No. CS-0100873
  • Purity ≥98%
  • MDL No. MFCD09025318
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₁₄BrNO₃
  • Molecular Weight 372.21
  • Synonym(s) ethanone, 2-bromo-1-[2-hydroxy-8-(phenylmethoxy)-5-quinolinyl]-
  • SMILES O=C1NC2=C(C(C(CBr)=O)=CC=C2OCC3=CC=CC=C3)C=C1

Synthesis

  • Route1

    References

    • Tanabe Seiyaku Co., Ltd. Patent: US4579854 A1, 1986 ;
  • Route2
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      1127-45-3
    • ~%
    • In-stock
      8-(Benzyloxy)-5-(2-bromoacetyl)quinolin-2(1H)-one|CS-0100873
      100331-89-3

    References

    • US2012/46467 A1, ;
  • Route3

    References

    • US2012/46467 A1, ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P363-P405-P501

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Computational Chemistry Data

  • TPSA   59.16
  • LogP   3.6847
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   5

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