1,1-Dimethylethyl-N-[(3-formylphenyl)methyl]carbamate

CAS No. 170853-04-0
Cat. No. CS-0211017
Purity≥97%
MDL No.MFCD06659091

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1,1-Dimethylethyl-N-[(3-formylphenyl)methyl]carbamate|CS-0211017

Structure of 170853-04-0

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Description

This carbamate derivative features a tert-butyl-protected amine linked to a benzaldehyde-bearing side chain, enabling selective conjugation under mild conditions. The aldehyde group facilitates efficient coupling with hydrazides or amines, while the sterically hindered tert-butyl moiety enhances stability and prevents unwanted side reactions during synthesis.

Application

1,1-Dimethylethyl-N-[(3-formylphenyl)methyl]carbamate serves as a stable, bench-ready building block for the synthesis of functionalized benzene derivatives. The formyl group enables direct electrophilic substitution or reductive amination, while the tert-butyl carbamate protects the amine under standard reaction conditions. This compound facilitates efficient access to substituted phenyl scaffolds and is compatible with diverse coupling and transformation protocols in medicinal chemistry workflows.

General Information

CAS No. 170853-04-0
Cat. No. CS-0211017
Purity ≥97%
MDL No. MFCD06659091
Storage 4°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₇NO₃
Molecular Weight 235.28
Synonym(s) tert-Butyl 3-formylbenzylcarbamate
SMILES CC(C)(OC(NCC1=CC(C=O)=CC=C1)=O)C

Computational Chemistry Data

TPSA 55.4
LogP 2.5238
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 3

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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Other Classifications

Building Blocks Functional Group Aldehyde

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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1,1-Dimethylethyl-N-[(3-formylphenyl)methyl]carbamate

CAS No. 170853-04-0

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