3-((tert-Butoxycarbonyl)amino)-3-(2,4-dichlorophenyl)propanoic acid

Name: 3-((tert-Butoxycarbonyl)amino)-3-(2,4-dichlorophenyl)propanoic acid
Brand: ChemScene
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CAS No. 683219-22-9
Cat. No. CS-0181502
Purity≥98%
MDL No.None

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3-((tert-Butoxycarbonyl)amino)-3-(2,4-dichlorophenyl)propanoic acid|CS-0181502

Structure of 683219-22-9

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Description

This protected amino acid derivative features a tert-butoxycarbonyl group enabling stable incorporation into peptide synthesis, while the 2,4-dichlorophenyl moiety imparts enhanced lipophilicity and metabolic stability. Designed for efficient coupling under standard conditions, it serves as a key building block in medicinal chemistry applications requiring robust functionalization.

Application

3-((tert-Butoxycarbonyl)amino)-3-(2,4-dichlorophenyl)propanoic acid serves as a stable, bench-ready building block for peptide and heterocyclic synthesis. The Boc-protected amine enables orthogonal functional group manipulation, while the 2,4-dichlorophenyl moiety provides a rigid, electron-deficient aryl handle suitable for cross-coupling and bioisosteric studies. Its carboxylic acid functionality facilitates direct amidation or esterification, supporting scalable access to pharmaceutically relevant scaffolds.

General Information

CAS No. 683219-22-9
Cat. No. CS-0181502
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₄H₁₇Cl₂NO₄
Molecular Weight 334.20
Synonym(s) BOC-DL-3-AMINO-3-(2,4-DICHLORO-PHENYL)-PROPIONIC ACID
SMILES O=C(NC(CC(O)=O)C1=CC=C(C=C1Cl)Cl)OC(C)(C)C

Computational Chemistry Data

TPSA 75.63
LogP 4.0339
H_Acceptors 3
H_Donors 2
Rotatable_Bonds 4

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-P302+P352

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Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Carboxylic Acid

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-((tert-Butoxycarbonyl)amino)-3-(2,4-dichlorophenyl)propanoic acid

CAS No. 683219-22-9

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