4-Bromo-N-(4-bromophenyl)-N-(4-(sec-butyl)phenyl)aniline

Name: 4-Bromo-N-(4-bromophenyl)-N-(4-(sec-butyl)phenyl)aniline
Brand: ChemScene
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CAS No. 287976-94-7
Cat. No. CS-0099346
Purity≥97%
MDL No.MFCD16038730

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FedEx Limited Quantities Ground	$0.00
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4-Bromo-N-(4-bromophenyl)-N-(4-(sec-butyl)phenyl)aniline|CS-0099346

Structure of 287976-94-7

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General Information

CAS No. 287976-94-7
Cat. No. CS-0099346
Purity ≥97%
MDL No. MFCD16038730
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₂H₂₁Br₂N
Molecular Weight 459.22
Synonym(s) bis(4-broMophenyl)-4-sec-butylaniline
SMILES CCC(C)C1=CC=C(C=C1)N(C2=CC=C(C=C2)Br)C3=CC=C(C=C3)Br

Description

This aniline derivative features two brominated aryl groups and a sterically hindered sec-butyl substituent, enabling enhanced stability and solubility in organic media. The para-bromophenyl and sec-butylphenyl moieties facilitate efficient coupling reactions in transition-metal-catalyzed transformations, particularly in the synthesis of conjugated materials for optoelectronic applications.

Application

4-Bromo-N-(4-bromophenyl)-N-(4-(sec-butyl)phenyl)aniline serves as a versatile building block in the synthesis of functionalized biaryl scaffolds. Its dual bromo substituents enable sequential cross-coupling reactions, while the sterically hindered sec-butyl group enhances metabolic stability and modulates solubility. The molecule exhibits excellent bench stability, facilitates straightforward purification by column chromatography, and functions reliably in Pd-catalyzed coupling protocols for constructing complex pharmaceutical intermediates and advanced materials.

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

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Computational Chemistry Data

TPSA 3.24
LogP 8.1949
H_Acceptors 1
H_Donors 0
Rotatable_Bonds 5

Other Classifications

Building Blocks Functional Group Amine

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-Bromo-N-(4-bromophenyl)-N-(4-(sec-butyl)phenyl)aniline

CAS No. 287976-94-7

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