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CS-W001157 4
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3-(Bromomethyl)-1-methylquinoxalin-2(1H)-one

  • CAS No. 1501-41-3

  • Cat. No. CS-0483749
  • Molecule weight253.10
  • Purity≥98%
  • MDL No.MFCD13192552

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

3-(Bromomethyl)-1-methylquinoxalin-2(1H)-one|CS-0483749

Structure of 1501-41-3

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General Information

  • CAS No. 1501-41-3
  • Cat. No. CS-0483749
  • Purity ≥98%
  • MDL No. MFCD13192552
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉BrN₂O
  • Molecular Weight 253.10
  • Synonym(s) 3-(bromomethyl)-1-methyl-1,2-dihydroquinoxalin-2-one
  • SMILES CN1C(=O)C(CBr)=NC2=CC=CC=C12

Synthesis

  • Route1

    References

    • Lawrence; Copper; Smith Journal of Medicinal Chemistry, 2001 , vol. 44, # 4 p. 594 - 601
  • Route2

    References

    • ACTELION PHARMACEUTICALS LTD; FISCHLI, Walter Patent: WO2004/96780 A1, 2004 ; Location in patent: Page 20 ; WO 2004/096780 A1
  • Route3

    References

    • Lawrence; Copper; Smith Journal of Medicinal Chemistry, 2001 , vol. 44, # 4 p. 594 - 601

Safety Information

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Computational Chemistry Data

  • TPSA   34.89
  • LogP   1.8284
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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