tert-Butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate

Name: tert-Butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate
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CAS No. 1367777-12-5
Cat. No. CS-0029893
Purity≥97%
MDL No.MFCD22035557

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tert-Butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate|CS-0029893

Structure of 1367777-12-5

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General Information

CAS No. 1367777-12-5
Cat. No. CS-0029893
Purity ≥97%
MDL No. MFCD22035557
Storage 4°C, protect from light, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₂₀N₂O₃
Molecular Weight 228.29
Synonym(s) 8-Boc-2-oxa-5,8-diazaspiro[3.5]nonane
SMILES O=C(N(C1)CCNC21COC2)OC(C)(C)C

Description

tert-Butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate features a spirocyclic scaffold integrating oxygen and nitrogen heteroatoms, delivering enhanced stability and solubility in polar organic media. This bench-stable, moisture-tolerant building block enables efficient incorporation into complex molecular architectures via mild deprotection and functionalization protocols.

Application

tert-Butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate serves as a versatile spirocyclic scaffold for medicinal chemistry and synthetic methodology development. The molecule combines a stable tert-butyl ester with a rigid, oxygen-bridged diazaspirocyclic core, enabling selective functionalization at the C8 position. Its bench-stable nature and tolerance to common reaction conditions facilitate downstream transformations, including reductive cleavage, nucleophilic displacement, and transition-metal-catalyzed coupling, making it a practical building block for complex heterocyclic systems.

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 50.8
LogP 0.5957
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Boc

Building Blocks Skeleton Aliphatic heterocycle compounds Piperazine compounds

Building Blocks Skeleton Aliphatic heterocycle compounds Oxetane compounds

Key Words

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tert-Butyl 2-oxa-5,8-diazaspiro[3.5]nonane-8-carboxylate

CAS No. 1367777-12-5

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