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Sigma-Aldrich

4-(Methylthio)benzyl bromide

97%

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About This Item

Empirical Formula (Hill Notation):
C8H9BrS
CAS Number:
38185-19-2
Molecular Weight:
217.13
MDL number:
MFCD05865196
UNSPSC Code:
12352100
PubChem Substance ID:
24882692
NACRES:
NA.22

assay

97%

form

solid

mp

43-47 °C (lit.)

functional group

bromo
thioether

SMILES string

CSc1ccc(CBr)cc1

InChI

1S/C8H9BrS/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,6H2,1H3

InChI key

QDLKMRTVELBKFE-UHFFFAOYSA-N

Application

4-(Methylthio)benzyl bromide can undergo self-catalyzed oxidation in the presence of hydrogen peroxide to form the corresponding sulfoxide.

pictograms

Skull and crossbonesCorrosion
GHS06,GHS05

signalword

Danger

Hazard Classifications

Acute Tox. 3 Oral - Skin Corr. 1B - Skin Sens. 1

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk_germany

WGK 3

flash_point_f

>230.0 °F - closed cup

flash_point_c

> 110 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

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Certificates of Analysis (COA)

Lot/Batch Number
BGBB4208V
1401286
03006PH
17923ME

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"Self-Catalyzed Oxidation of Sulfides with Hydrogen Peroxide: A Green and Practical Process for the Synthesis of Sulfoxides"
Shi F, et al.
Advanced Synthesis & Catalysis, 349(16), 2425-2430 (2007)

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