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CS-W001157 4
Total: USD 88.00

Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate

  • CAS No. 658082-39-4

  • Cat. No. CS-0150778
  • Molecule weight203.19
  • Purity≥98%
  • MDL No.MFCD18250896

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

Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate|CS-0150778

Structure of 658082-39-4

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General Information

  • CAS No. 658082-39-4
  • Cat. No. CS-0150778
  • Purity ≥98%
  • MDL No. MFCD18250896
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₉NO₃
  • Molecular Weight 203.19
  • Synonym(s) methyl 1,2-dihydro-1-oxo-7-Isoquinolinecarboxylate
  • SMILES COC(=O)C1=CC2=C(N=CC=C2C=C1)O

Synthesis

  • Route1
    • null|null
      67-56-1
    • null|null
      201230-82-2
    • In-stock
      7-Bromoisoquinolin-1-ol|CS-W002844
      223671-15-6
    • ~81%
    • In-stock
      Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate|CS-0150778
      658082-39-4

    References

    • Millennium Pharmaceuticals, Inc. Patent: US2012/94997 A1, 2012 ; Location in patent: Page/Page column 75 ; US 20120094997 A1
  • Route2
    • null|null
      201230-82-2
    • In-stock
      7-Bromoisoquinolin-1-ol|CS-W002844
      223671-15-6
    • ~87%
    • In-stock
      Methyl 1-oxo-1,2-dihydroisoquinoline-7-carboxylate|CS-0150778
      658082-39-4

    References

    • WARNER-LAMBERT COMPANY LLC Patent: WO2004/14379 A1, 2004 ; Location in patent: Page/Page column 112 ; WO 2004/014379 A1

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   59.42
  • LogP   1.727
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   1

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