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CS-W001157 4
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beta-Isocupreidine

  • CAS No. 253430-48-7

  • Cat. No. CS-0062344
  • Molecule weight310.40
  • Purity≥97%
  • MDL No.MFCD11975433

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

beta-Isocupreidine|CS-0062344

Structure of 253430-48-7

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General Information

  • CAS No. 253430-48-7
  • Cat. No. CS-0062344
  • Purity ≥97%
  • MDL No. MFCD11975433
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₉H₂₂N₂O₂
  • Molecular Weight 310.40
  • Synonym(s) (9S)-3α,9-Epoxy-10,11-dihydrocinchonan-6'-ol
  • SMILES CC[C@@](C[N@@]1CC2)(O3)[C@@H]2C[C@@H]1[C@@H]3C4=CC=NC5=CC=C(O)C=C45

Description

beta-Isocupreidine features a rigid, electron-rich heterocyclic core with enhanced stability under standard bench conditions. This nitrogen-containing scaffold integrates readily into synthetic sequences requiring strong basicity and directional coordination. Its well-defined stereochemistry enables precise control in catalytic transformations and ligand design.

Application

beta-Isocupreidine serves as a versatile nitrogen-containing heterocyclic building block, enabling efficient access to complex alkaloid scaffolds and pharmaceutical intermediates. Its rigid, polycyclic structure exhibits favorable functional group tolerance and stability under standard synthetic conditions, facilitating selective transformations in medicinal chemistry workflows. The molecule functions effectively in transition-metal-catalyzed couplings and electrophilic substitutions, offering reliable reactivity for the construction of bioactive architectures.

Safety Information

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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-P362-P405-P501

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Computational Chemistry Data

  • TPSA   45.59
  • LogP   3.2547
  • H_Acceptors   4
  • H_Donors   1
  • Rotatable_Bonds   2

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