2-Fluoro-5-(trifluoromethyl)benzene-1-sulfonyl chloride

Name: 2-Fluoro-5-(trifluoromethyl)benzene-1-sulfonyl chloride
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CAS No. 1744-43-0
Cat. No. CS-0187857
Molecule weight262.61
Purity≥98%
MDL No.None

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2-Fluoro-5-(trifluoromethyl)benzene-1-sulfonyl chloride|CS-0187857

Structure of 1744-43-0

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General Information

CAS No. 1744-43-0
Cat. No. CS-0187857
Purity ≥98%
MDL No. None
Storage 4°C, sealed storage, away from moisture
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₃ClF₄O₂S
Molecular Weight 262.61
Synonym(s) 3-(Chlorosulphonyl)-4-fluorobenzotrifluoride
SMILES C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)F

Description

2-Fluoro-5-(trifluoromethyl)benzene-1-sulfonyl chloride features a highly electron-deficient aromatic ring stabilized by orthogonal fluorine and trifluoromethyl substituents, enabling selective sulfonylation under mild conditions. This bench-stable reagent integrates efficiently into complex molecule synthesis, delivering robust functional group transformation with minimal side reactivity.

Application

2-Fluoro-5-(trifluoromethyl)benzene-1-sulfonyl chloride serves as a versatile electrophilic sulfonating agent, enabling efficient introduction of the trifluoromethyl-substituted sulfonyl group into diverse substrates. Its high reactivity facilitates clean derivatization of amines and alcohols under mild conditions, with excellent bench stability and straightforward purification. This reagent functions effectively in the synthesis of functionalized aryl sulfonamides and sulfonates, offering robust compatibility across standard synthetic workflows.

Safety Information

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GHS Pictogram :	GHS No : GHS05,GHS07
Signal Word : Danger	UN#: 3265
Class : 8	Packing Group : Ⅱ
Hazard Statements : H302-H312-H314-H332
Precautionary Statements : P260-P261-P264-P270-P271-P280-P301+P330+P331-P302+P352-P304+P340-P330-P362+P364-P363-P405-P501

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Computational Chemistry Data

TPSA 34.14
LogP 2.772
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Sulfonyl Chloride

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Fluoro-5-(trifluoromethyl)benzene-1-sulfonyl chloride

CAS No. 1744-43-0

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