Skip to Content
Merck
All Photos(2)

Documents

196525

Sigma-Aldrich

4-Bromothioanisole

97%

Synonym(s):

4-Bromophenyl methyl sulfide

Sign Into View Organizational & Contract Pricing
All Photos(2)

About This Item

Linear Formula:
BrC6H4SCH3
CAS Number:
104-95-0
Molecular Weight:
203.10
EC Number:
203-255-8
MDL number:
MFCD00000102
UNSPSC Code:
12352100
PubChem Substance ID:
24851767
NACRES:
NA.22

Assay

97%

bp

128-130 °C/10 mmHg (lit.)

mp

38-40 °C (lit.)

SMILES string

CSc1ccc(Br)cc1

InChI

1S/C7H7BrS/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3

InChI key

YEUYZNNBXLMFCW-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

General description

4-Bromothioanisole undergoes Heck olefination reaction with styrenes to yield stilbenes.

Application

4-Bromothioanisole was used in the synthesis of:
  • 4′-nitro-4-mercaptobiphenyl
  • 4′-iodo-4-mercaptobiphenyl
  • 3′-nitro-4-mercaptobiphenyl
  • 3′-iodo-4-mercaptiobiphenyl
  • (S)-(–)-p-bromophenyl methyl sulfoxide

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H302

Precautionary Statements

P264 - P270 - P301 + P312 - P501

Hazard Classifications

Acute Tox. 4 Oral

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Enantioselective Oxidation of an Alkyl Aryl Sulfide: Synthesis of (S)-(-)-Methyl P-Bromophenyl Sulfoxide.
Drago C, et al.
Organic Syntheses, 86, 121-129 (2009)
Novel 1, 2-diarylcyclobutenes: Selective and orally active COX-2 inhibitors.
Friesen RW, et al.
Bioorganic & Medicinal Chemistry Letters, 6(22), 2677-2682 (1996)
Rupa Hiremath et al.
Chemical communications (Cambridge, England), (23)(23), 2676-2677 (2004-11-30)
Orthorhombic and triclinic crystals of 2-iodo-4-nitroaniline (INA) grow concomitantly from supersaturated ethanol solutions, but the less stable orthorhombic phase can be selectively grown on 3'-X-4-mercaptobiphenyl (X = NO(2), I) self-assembled monolayer templates.
Isolation of S-(bromophenyl)cysteine isomers from liver proteins of bromobenzene-treated rats.
P E Weller et al.
Chemical research in toxicology, 4(1), 17-20 (1991-01-01)
Vasiliy Yu Evtushok et al.
Frontiers in chemistry, 7, 858-858 (2020-01-11)
In this work, we elaborated heterogeneous catalysts on the basis of the Venturello complex [PO4{WO(O2)2}4]3- (PW4) and nitrogen-free or nitrogen-doped carbon nanotubes (CNTs or N-CNTs) for epoxidation of alkenes and sulfoxidation of thioethers with aqueous hydrogen peroxide. Catalysts PW4/CNTs and

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service