(S)-4-(tert-Butyl)-2-(5,6,7,8-tetrahydroquinolin-2-yl)-4,5-dihydrooxazole

Name: (S)-4-(tert-Butyl)-2-(5,6,7,8-tetrahydroquinolin-2-yl)-4,5-dihydrooxazole
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CAS No. 2757082-78-1
Cat. No. CS-0610793
Molecule weight258.36
Purity≥97%
MDL No.None

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(S)-4-(tert-Butyl)-2-(5,6,7,8-tetrahydroquinolin-2-yl)-4,5-dihydrooxazole|CS-0610793

Structure of 2757082-78-1

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General Information

CAS No. 2757082-78-1
Cat. No. CS-0610793
Purity ≥97%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₂₂N₂O
Molecular Weight 258.36
Synonym(s) None
SMILES CC(C)(C)[C@@H](CO1)N=C1C2=CC=C(CCCC3)C3=N2

Description

This chiral oxazole features a sterically hindered tert-butyl group and a saturated quinoline core, enabling precise stereochemical control in asymmetric synthesis. The fused tetrahydroquinoline moiety enhances π-stacking potential and solubility in organic media. Designed for integration into complex heterocycles, this scaffold offers robust stability under standard bench conditions and facilitates efficient coupling reactions in medicinal chemistry applications.

Application

(S)-4-(tert-Butyl)-2-(5,6,7,8-tetrahydroquinolin-2-yl)-4,5-dihydrooxazole serves as a versatile chiral building block for the synthesis of bioactive heterocycles. Its oxazole core exhibits robust stability under standard reaction conditions and enables efficient coupling with nucleophiles or transition metal catalysts. The tert-butyl group enhances solubility and facilitates purification, while the tetrahydroquinoline moiety provides a rigid, pharmacophoric scaffold relevant to medicinal chemistry. Functions effectively in Pd-catalyzed cross-coupling and reductive amination workflows.

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 34.48
LogP 3.1519
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Key Words

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(S)-4-(tert-Butyl)-2-(5,6,7,8-tetrahydroquinolin-2-yl)-4,5-dihydrooxazole

CAS No. 2757082-78-1

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