Lot numbers can be found on the outside label of a product:
tert-Butyl 2-aminobenzylcarbamate
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CAS No. 162046-50-6
- Cat. No. CS-W022986
- Purity≥96%
- MDL No.MFCD04071350
*For research and further manufacturing use only, not for direct human use.
Structure of 162046-50-6
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General Information
- CAS No. 162046-50-6
- Cat. No. CS-W022986
- Purity ≥96%
- MDL No. MFCD04071350
- Storage 4°C, protect from light
- Shipping Room temperature in continental US; may vary elsewhere.
- Molecular Formula C₁₂H₁₈N₂O₂
- Molecular Weight None
- Synonym(s) (2-Amino-benzyl)-carbamic acid tert-butyl ester
- SMILES O=C(OC(C)(C)C)NCC1=CC=CC=C1N
Description
tert-Butyl 2-aminobenzylcarbamate features a protected amine group flanked by a benzyl moiety, enabling selective functionalization in peptide synthesis. This bench-stable, moisture-tolerant reagent integrates readily into complex molecular architectures under standard conditions.
Application
tert-Butyl 2-aminobenzylcarbamate serves as a versatile protected amine synthon in medicinal chemistry, enabling efficient access to biologically relevant benzylamine scaffolds. The tert-butyl carbamate (Boc) group provides excellent bench stability and orthogonal deprotection under mild acidic conditions, facilitating sequential functionalization. It participates reliably in standard coupling reactions and supports the construction of complex heterocycles, including indoles and benzimidazoles, via straightforward transformation pathways.
Synthesis
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References
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Brady, Ryan M.; Khakham, Yelena; Lessene, Guillaume; Baell, Jonathan B. Organic and Biomolecular Chemistry, 2011 , vol. 9, # 3 p. 656 - 658
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Route2
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163423-99-2 - ~75%
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In-stock
162046-50-6
References
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Nihon Nohyaku Co., Ltd. Patent: JP2005/314407 A, 2005 ; Location in patent: Page/Page column 57 ;
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Route3
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In-stock
24424-99-5 - ~%
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In-stock
162046-50-6
References
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Bioorganic and Medicinal Chemistry, , vol. 19, # 5 p. 1623 - 1642
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Safety Information
Download SDS|
GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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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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Quality Control
Computational Chemistry Data
- TPSA 64.35
- LogP 2.2935
- H_Acceptors 3
- H_Donors 2
- Rotatable_Bonds 2
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Key Words
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