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Key Documents

ALD00468

Sigma-Aldrich

sodium (4-chlorophenyl)methanesulfinate

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About This Item

Empirical Formula (Hill Notation):
C7H6ClNaO2S
Molecular Weight:
212.63
UNSPSC Code:
12352101
PubChem Substance ID:
NACRES:
NA.06

form

powder

Quality Level

reaction suitability

reaction type: C-C Bond Formation

SMILES string

ClC1=CC=C(CS(O[Na])=O)C=C1

InChI

1S/C7H7ClO2S.Na/c8-7-3-1-6(2-4-7)5-11(9)10;/h1-4H,5H2,(H,9,10);/q;+1/p-1

InChI key

UXCLCCYBFMAOBU-UHFFFAOYSA-M

General description

Sodium (4-chlorophenyl)methanesulfinate is an alkyl Baran Diversinate. These reagents facilitate the functionalization of heteroaromatic C-H bonds under simple reaction conditions.

Application

The following Baran Sulfinate is a part of a toolbox of diversification reagents, which are ideal for the late-stage functionalization of nitrogen-containing heterocycles. The regioselectivity can be effectively tuned by modification of the pH and solvent selection.

Legal Information

Diversinates is a trademark of Sigma-Aldrich Co. LLC

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3


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