tert-Butyl oct-7-yn-1-ylcarbamate

Name: tert-Butyl oct-7-yn-1-ylcarbamate
Brand: ChemScene
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CAS No. 1451262-84-2
Cat. No. CS-0614536
Purity≥97%
MDL No.MFCD31729564

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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tert-Butyl oct-7-yn-1-ylcarbamate|CS-0614536

Structure of 1451262-84-2

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General Information

CAS No. 1451262-84-2
Cat. No. CS-0614536
Purity ≥97%
MDL No. MFCD31729564
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₂₃NO₂
Molecular Weight 225.33
Synonym(s) N-Boc-oct-7-yn-1-amine
SMILES O=C(OC(C)(C)C)NCCCCCCC#C

Description

tert-Butyl oct-7-yn-1-ylcarbamate features a terminal alkyne handle flanked by a sterically hindered tert-butyl carbamate group, enabling robust protection and selective coupling in multistep synthesis. This stable, bench-ready reagent facilitates efficient CuAAC reactions and integrates seamlessly into complex molecular architectures requiring orthogonal functionalization.

Application

tert-Butyl oct-7-yn-1-ylcarbamate serves as a robust, bench-stable building block for the synthesis of alkyne-functionalized intermediates. Its terminal alkyne moiety enables efficient copper-catalyzed azide-alkyne cycloaddition (CuAAC), while the tert-butoxycarbonyl (Boc) group provides orthogonal protection for primary amines. The molecule exhibits excellent functional group tolerance and facilitates straightforward purification, making it well-suited for iterative peptide and heterocycle assembly in medicinal chemistry workflows.

Safety Information

Download SDS

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 38.33
LogP 3.0948
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 6

Other Classifications

Life Science PROTAC PROTAC Linker

Life Science Click Chemistry Reagents Alkyne

Building Blocks Skeleton Fatty chain compounds

Building Blocks Functional Group Boc

Building Blocks Functional Group Alkyne

Chemical Biology Pharmaceutical Development and Drug Discovery Research Reagents Proteolysis Targeting Chimera Research Reagents

Chemical Biology Conjugation Chemistry/Click Chemistry Terminal Alkynes

Biochemistry Pharmaceutical Development and Drug Discovery Research Proteolysis Targeting Chimera Research Reagents

Chemical Biology Pharmaceutical Development and Drug Discovery Research Conjugation Chemistry/Click Chemistry Terminal Alkynes

Key Words

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tert-Butyl oct-7-yn-1-ylcarbamate

CAS No. 1451262-84-2

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