2-Chloro-4-(2,2,2-trifluoroethoxy)pyrimidine

Name: 2-Chloro-4-(2,2,2-trifluoroethoxy)pyrimidine
Brand: ChemScene
Availability: InStock
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CAS No. 935252-67-8
Cat. No. CS-0059958
Purity≥97%
MDL No.None

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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2-Chloro-4-(2,2,2-trifluoroethoxy)pyrimidine|CS-0059958

Structure of 935252-67-8

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General Information

CAS No. 935252-67-8
Cat. No. CS-0059958
Purity ≥97%
MDL No. None
Storage -20°C, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₄ClF₃N₂O
Molecular Weight 212.56
Synonym(s) None
SMILES C=1(N=C(C=CN1)OCC(F)(F)F)Cl

Description

2-Chloro-4-(2,2,2-trifluoroethoxy)pyrimidine features a trifluoroethoxy group that enhances metabolic stability and lipophilicity, while the chloropyrimidine core enables efficient coupling in cross-coupling reactions. This compound serves as a key building block for pharmaceutical intermediates requiring electron-deficient heterocyclic scaffolds.

Application

2-Chloro-4-(2,2,2-trifluoroethoxy)pyrimidine serves as a versatile building block in medicinal chemistry, enabling efficient C–H functionalization and cross-coupling reactions. Its trifluoroethoxy group enhances metabolic stability and lipophilicity, while the pyrimidine core facilitates incorporation into bioactive scaffolds. The molecule exhibits excellent bench stability and compatibility with palladium-catalyzed coupling protocols, simplifying purification and scale-up.

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-H320-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 35.01
LogP 2.0711
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Skeleton Aromatic heterocycle compounds Pyrimidine compounds

Key Words

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2-Chloro-4-(2,2,2-trifluoroethoxy)pyrimidine

CAS No. 935252-67-8

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