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Key Documents

ALD00462

Sigma-Aldrich

Sodium 2-(2-Bromophenyl)-1,1-difluoroethanesulfinate

95%

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About This Item

Empirical Formula (Hill Notation):
C8H6BrF2NaO2S
CAS Number:
Molecular Weight:
307.09
UNSPSC Code:
12352101
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

95%

form

powder

reaction suitability

reaction type: C-C Bond Formation
reagent type: catalyst
reaction type: C-H Activation

SMILES string

BrC1=CC=C(CC(F)(F)S(O[Na])=O)C=C1

InChI

1S/C8H7BrF2O2S.Na/c9-7-3-1-6(2-4-7)5-8(10,11)14(12)13;/h1-4H,5H2,(H,12,13);/q;+1/p-1

InChI key

MGXWINRJXWSLAL-UHFFFAOYSA-M

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.

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

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable


Certificates of Analysis (COA)

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