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CS-W001157 4
Total: USD 88.00

8-Nitro-1,2,3,4-tetrahydroisoquinoline

  • CAS No. 791040-11-4

  • Cat. No. CS-0466457
  • Molecule weight178.19
  • Purity≥98%
  • MDL No.MFCD12828137

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

8-Nitro-1,2,3,4-tetrahydroisoquinoline|CS-0466457

Structure of 791040-11-4

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General Information

  • CAS No. 791040-11-4
  • Cat. No. CS-0466457
  • Purity ≥98%
  • MDL No. MFCD12828137
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀N₂O₂
  • Molecular Weight 178.19
  • Synonym(s) None
  • SMILES C1=CC2=C(CNCC2)C(=C1)[N+](=O)[O-]

Synthesis

  • Route1
    • 1-(6-Nitro-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one|CS-0512471
      174648-97-6
    • 1-(8-Nitro-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one|CS-1026830
      174648-94-3
    • ~%
    • 8-Nitro-1,2,3,4-tetrahydroisoquinoline|CS-0466457
      791040-11-4
    • In-stock
      6-Nitro-1,2,3,4-tetrahydroisoquinoline|CS-D1801
      186390-77-2

    References

    • BUOLAMWINI, John, K, Patent: WO2004/60902 A2, 2004 ; Location in patent: Page/Page column 18 ; WO 2004/060902 A2
  • Route2
    • 1-(8-Nitro-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one|CS-1026830
      174648-94-3
    • ~%
    • 8-Nitro-1,2,3,4-tetrahydroisoquinoline|CS-0466457
      791040-11-4

    References

    • Zhu, Zhengxiang; Furr, John; Buolamwini, John K. Journal of Medicinal Chemistry, 2003 , vol. 46, # 5 p. 831 - 837
  • Route3

    References

    • Zhu, Zhengxiang; Furr, John; Buolamwini, John K. Journal of Medicinal Chemistry, 2003 , vol. 46, # 5 p. 831 - 837

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-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.17
  • LogP   1.2405
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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