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tert-Butyl octahydro-1H-pyrrolo[3,2-b]pyridine-1-carboxylate

  • CAS No. 1211586-14-9

  • Cat. No. CS-0037056
  • Molecule weight226.32
  • Purity≥98%
  • MDL No.MFCD18382710

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

tert-Butyl octahydro-1H-pyrrolo[3,2-b]pyridine-1-carboxylate|CS-0037056

Structure of 1211586-14-9

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General Information

  • CAS No. 1211586-14-9
  • Cat. No. CS-0037056
  • Purity ≥98%
  • MDL No. MFCD18382710
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₂N₂O₂
  • Molecular Weight 226.32
  • Synonym(s) Octahydro-pyrrolo[3,2-b]pyridine-1-carboxylic acid tert-butyl ester
  • SMILES CC(C)(C)OC(=O)N1CCC2C1CCCN2

Description

tert-Butyl octahydro-1H-pyrrolo[3,2-b]pyridine-1-carboxylate is a bench-stable, moisture-tolerant carbamate protecting group for secondary amines in complex amine synthesis. This saturated heterocyclic scaffold integrates seamlessly into medicinal chemistry libraries, offering enhanced solubility and compatibility with standard deprotection protocols.

Application

tert-Butyl octahydro-1H-pyrrolo[3,2-b]pyridine-1-carboxylate serves as a stable, bench-ready nitrogen heterocycle building block for medicinal chemistry and catalytic synthesis. The protected pyrrolidine core enables efficient functionalization at the C1 position, with excellent tolerance to standard coupling and reduction conditions. Its robust tert-butyl carbamate group facilitates straightforward deprotection under mild acidic conditions, enabling rapid access to the parent amine for further derivatization in API development workflows.

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

Quality Control

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Computational Chemistry Data

  • TPSA   41.57
  • LogP   1.7478
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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