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CS-W001157 4
Total: USD 88.00

Methyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate

  • CAS No. 163160-56-3

  • Cat. No. CS-0312888
  • Molecule weight282.09
  • Purity95+%
  • MDL No.None

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

Methyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate|CS-0312888

Structure of 163160-56-3

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General Information

  • CAS No. 163160-56-3
  • Cat. No. CS-0312888
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₈BrNO₃
  • Molecular Weight 282.09
  • Synonym(s) Methyl 2-(5-Bromo-3-indolyl)-2-oxoacetate
  • SMILES COC(=O)C(=O)C1=CNC2=C1C=C(C=C2)Br

Synthesis

  • Route1
    • null|null
      67-56-1
    • null|null
      63843-81-2
    • ~96%
    • Methyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate|CS-0312888
      163160-56-3

    References

    • PROGENICS PHARMACEUTICALS, INC. Patent: WO2009/155527 A2, 2009 ; Location in patent: Page/Page column 237-238 ; WO 2009/155527 A2
  • Route2
    • null|null
      124-41-4
    • null|null
      63843-81-2
    • ~%
    • Methyl 2-(5-bromo-1H-indol-3-yl)-2-oxoacetate|CS-0312888
      163160-56-3

    References

    • Ye, Qing; Li, Meng; Zhou, Yubo; Pang, Tao; Xu, Lei; Cao, Jiayi; Han, Liang; Li, Yujin; Wang, Weisi; Gao, Jianrong; Li, Jia Molecules, 2013 , vol. 18, # 5 p. 5498 - 5516
  • Route3

    References

    • Ye, Qing; Li, Meng; Zhou, Yubo; Pang, Tao; Xu, Lei; Cao, Jiayi; Han, Liang; Li, Yujin; Wang, Weisi; Gao, Jianrong; Li, Jia Molecules, 2013 , vol. 18, # 5 p. 5498 - 5516

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H317
Precautionary Statements : P261-P264-P270-P272-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   59.16
  • LogP   2.2861
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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