tert-Butyl N-(azepan-4-yl)carbamate

Name: tert-Butyl N-(azepan-4-yl)carbamate
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CAS No. 454451-28-6
Cat. No. CS-0048053
Purity≥97%
MDL No.None

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tert-Butyl N-(azepan-4-yl)carbamate|CS-0048053

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General Information

CAS No. 454451-28-6
Cat. No. CS-0048053
Purity ≥97%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₂₂N₂O₂
Molecular Weight 214.30
Synonym(s) Tert-butyl azepan-4-ylcarbamate
SMILES CC(C)(C)OC(=O)NC1CCCNCC1

Description

tert-Butyl N-(azepan-4-yl)carbamate serves as a stable, moisture-tolerant protecting group for primary amines in complex amine synthesis. This carbamate derivative features a sterically hindered tert-butyl moiety that facilitates selective deprotection under mild acidic conditions, enabling efficient access to functionalized azepane scaffolds. The azepan-4-yl core provides a rigid, electron-rich heterocyclic framework suitable for medicinal chemistry applications.

Application

tert-Butyl N-(azepan-4-yl)carbamate serves as a stable, bench-friendly protecting group for primary amines, enabling straightforward deprotection under mild acidic conditions. It functions as a key building block in the synthesis of azepane-containing scaffolds prevalent in medicinal chemistry, offering excellent functional group tolerance and compatibility with standard coupling and reduction 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 50.36
LogP 1.6532
H_Acceptors 3
H_Donors 2
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Amine

Building Blocks Skeleton Aliphatic heterocycle compounds Other aliphatic heterocycles compounds

Key Words

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tert-Butyl N-(azepan-4-yl)carbamate

CAS No. 454451-28-6

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