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CS-W001157 4
Total: USD 88.00

Isoquinoline-5-carboxaldehyde

  • CAS No. 80278-67-7

  • Cat. No. CS-W004003
  • Purity≥97%
  • MDL No.MFCD03412483

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

Isoquinoline-5-carboxaldehyde|CS-W004003

Structure of 80278-67-7

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General Information

  • CAS No. 80278-67-7
  • Cat. No. CS-W004003
  • Purity ≥97%
  • MDL No. MFCD03412483
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₇NO
  • Molecular Weight 157.17
  • Synonym(s) Isoquinoline-5-carbaldehyde
  • SMILES O=Cc1cccc2c1ccnc2

Description

Isoquinoline-5-carboxaldehyde features a rigid heteroaromatic core with a strategically positioned aldehyde group, enabling direct coupling in multistep syntheses. This bench-stable scaffold integrates readily into bioactive molecule frameworks, offering high reactivity under standard conditions while maintaining compatibility with diverse functional groups.

Synthesis

  • Route1
    • In-stock
      5-Bromoisoquinoline|CS-W007854
      34784-04-8
    • null|null
      68-12-2
    • ~64%
    • In-stock
      Isoquinoline-5-carboxaldehyde|CS-W004003
      80278-67-7

    References

    • DarPharma, Inc. Patent: US2007/155720 A1, 2007 ; Location in patent: Page/Page column 24 ; US 20070155720 A1
  • Route2
    • null|null
      68-12-2
    • ~63%
    • In-stock
      Isoquinoline-5-carboxaldehyde|CS-W004003
      80278-67-7

    References

    • DARPHARMA, INC. Patent: WO2006/12640 A2, 2006 ; Location in patent: Page/Page column 53 ; WO 2006/012640 A2
  • Route3

    References

    • Plobeck; Delorme; Wei; Yang; Zhou; Schwarz; Gawell; Gagnon; Pelcman; Schmidt; Yue; Walpole; Brown; Labare; Payza; St-Ogne; Kamassah; Morin; Projean; Ducharme; Roberts Journal of Medicinal Chemistry, 2000 , vol. 43, # 21 p. 3878 - 3894

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-H319
Precautionary Statements : P264-P270-P280-P330-P501

Quality Control

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Computational Chemistry Data

  • TPSA   29.96
  • LogP   2.0473
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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