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CS-W001157 4
Total: USD 88.00

Methyl 2-(isoquinolin-1-yl)acetate

  • CAS No. 69582-93-0

  • Cat. No. CS-0150703
  • Molecule weight201.22
  • Purity≥97%
  • MDL No.MFCD13194757

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

Methyl 2-(isoquinolin-1-yl)acetate|CS-0150703

Structure of 69582-93-0

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General Information

  • CAS No. 69582-93-0
  • Cat. No. CS-0150703
  • Purity ≥97%
  • MDL No. MFCD13194757
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₁NO₂
  • Molecular Weight 201.22
  • Synonym(s) Methyl 1-isoquinolylacetate
  • SMILES COC(=O)CC1=NC=CC2=CC=CC=C21

Synthesis

  • Route1
    • null|null
      69582-88-3
    • ~58%
    • In-stock
      Methyl 2-(isoquinolin-1-yl)acetate|CS-0150703
      69582-93-0

    References

    • Baruah, Pranjal K.; Dinsmore, Jason; King, Amber M.; Salome, Christophe; De Ryck, Marc; Kaminski, Rafal; Provins, Laurent; Kohn, Harold Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 11 p. 3551 - 3564
  • Route2
    • null|null
      316790-99-5
    • ~79%
    • In-stock
      Methyl 2-(isoquinolin-1-yl)acetate|CS-0150703
      69582-93-0

    References

    • Durst, Toni; Finke, Juergen A.; Huisgen, Rolf; Temme, Robert Helvetica Chimica Acta, 2000 , vol. 83, # 9 p. 2363 - 2382
  • Route3
    • null|null
      119-26-6
    • null|null
      316790-99-5
    • ~65%
    • In-stock
      Methyl 2-(isoquinolin-1-yl)acetate|CS-0150703
      69582-93-0
    • null|null
      28833-53-6

    References

    • Helvetica Chimica Acta, , vol. 83, # 9 p. 2363 - 2382

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   39.19
  • LogP   1.9503
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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