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CS-W001157 4
Total: USD 88.00

1-Methyl-3,4-dihydroisoquinoline

  • CAS No. 2412-58-0

  • Cat. No. CS-0152737
  • Molecule weight145.20
  • Purity≥98%
  • MDL No.MFCD00047648

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

1-Methyl-3,4-dihydroisoquinoline|CS-0152737

Structure of 2412-58-0

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General Information

  • CAS No. 2412-58-0
  • Cat. No. CS-0152737
  • Purity ≥98%
  • MDL No. MFCD00047648
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁N
  • Molecular Weight 145.20
  • Synonym(s) 3,4-Dihydro-1-methylisoquinoline
  • SMILES CC1=NCCC2=CC=CC=C12

Description

1-Methyl-3,4-dihydroisoquinoline is a bench-stable, electron-rich heterocycle featuring a saturated isoquinoline core with a methyl group at the nitrogen. This scaffold integrates readily into medicinal chemistry libraries, serving as a key building block for CNS-targeted therapeutics and bioactive alkaloid analogs.

Application

1-Methyl-3,4-dihydroisoquinoline serves as a versatile scaffold in medicinal chemistry, enabling efficient construction of isoquinoline-based pharmacophores. Its functional group tolerance and bench-stable nature facilitate straightforward derivatization via electrophilic substitution, Pd-catalyzed coupling, or reductive amination. The compound functions effectively as a building block for heterocyclic systems and bioactive molecule synthesis, particularly in CNS-targeted drug discovery.

Synthesis

  • Route1

    References

    • Rathelot; Vanelle; Gasquet; Delmas; Crozet; Timon-David; Maldonado European Journal of Medicinal Chemistry, 1995 , vol. 30, # 6 p. 503 - 508
  • Route2

    References

    • Ajzert, Ilona K.; Takacs, Kalman Liebigs Annalen der Chemie, 1987 , p. 1061 - 1064
  • Route3
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    • ~%
    • In-stock
      1-Methyl-3,4-dihydroisoquinoline|CS-0152737
      2412-58-0

    References

    • Rathelot; Vanelle; Gasquet; Delmas; Crozet; Timon-David; Maldonado European Journal of Medicinal Chemistry, 1995 , vol. 30, # 6 p. 503 - 508

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   12.36
  • LogP   2.0517
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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