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CS-W001157 4
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4,7-Diaza-spiro[2.5]octane-4-carboxylic acid tert-butyl ester

  • CAS No. 674792-08-6

  • Cat. No. CS-D0760
  • Purity≥97%
  • MDL No.MFCD08685932

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

4,7-Diaza-spiro[2.5]octane-4-carboxylic acid tert-butyl ester|CS-D0760

Structure of 674792-08-6

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General Information

  • CAS No. 674792-08-6
  • Cat. No. CS-D0760
  • Purity ≥97%
  • MDL No. MFCD08685932
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₀N₂O₂
  • Molecular Weight 212.29
  • Synonym(s) 4-Boc-4,7-diazaspiro[2.5]octane
  • SMILES O=C(OC(C)(C)C)N1C2(CNCC1)CC2

Description

This tert-butyl ester derivative of 4,7-diaza-spiro[2.5]octane-4-carboxylic acid features a rigid spirocyclic core with strategically positioned nitrogen atoms, enabling efficient incorporation into constrained scaffolds. The ester group enhances solubility and stability during synthetic manipulations, facilitating downstream transformations.

Application

4,7-Diaza-spiro[2.5]octane-4-carboxylic acid tert-butyl ester serves as a versatile bicyclic scaffold for medicinal chemistry and catalytic synthesis. Its spirocyclic core provides defined stereochemistry and rigidity, while the tert-butyl ester group enables straightforward deprotection and functionalization. The molecule exhibits excellent bench stability, tolerates a range of reaction conditions, and facilitates efficient incorporation into complex heterocycles and drug-like molecules through standard amide coupling and reductive amination protocols.

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

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Computational Chemistry Data

  • TPSA   41.57
  • LogP   1.3593
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   0

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