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CS-W001157 4
Total: USD 88.00

Isoquinoline-3-carboxamide

  • CAS No. 50458-77-0

  • Cat. No. CS-0130015
  • Purity≥98%
  • MDL No.MFCD00160690

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

Isoquinoline-3-carboxamide|CS-0130015

Structure of 50458-77-0

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General Information

  • CAS No. 50458-77-0
  • Cat. No. CS-0130015
  • Purity ≥98%
  • MDL No. MFCD00160690
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈N₂O
  • Molecular Weight 172.18
  • Synonym(s) 3-Isoquinolinecarboxamide
  • SMILES O=C(C1=CC2=C(C=N1)C=CC=C2)N

Synthesis

  • Route1
    • null|null
      663170-97-6
    • ~82%
    • In-stock
      Isoquinoline-3-carboxamide|CS-0130015
      50458-77-0

    References

    • Chezal, Jean M.; Moreau, Emmanuel; Desbois, Nicolas; Blache, Yves; Chavignon, Olivier; Teulade, Jean C. Tetrahedron Letters, 2004 , vol. 45, # 3 p. 553 - 556
  • Route2

    References

    • Teague; Roe Journal of the American Chemical Society, 1951 , vol. 73, p. 688
  • Route3

    References

    • Langry, Kevin C. Organic Preparations and Procedures International, 1994 , vol. 26, # 4 p. 429 - 438

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   55.98
  • LogP   1.3337
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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