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T28002

Sigma-Aldrich

Thioanisole

ReagentPlus®, ≥99%

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Synonym(s):
Methyl phenyl sulfide
Linear Formula:
C6H5SCH3
CAS Number:
Molecular Weight:
124.20
Beilstein/REAXYS Number:
1904179
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.21

Quality Level

product line

ReagentPlus®

assay

≥99%

refractive index

n20/D 1.587 (lit.)

bp

188 °C (lit.)

mp

−15 °C (lit.)

density

1.057 g/mL at 20 °C (lit.)

SMILES string

CSc1ccccc1

InChI

1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,1H3

InChI key

HNKJADCVZUBCPG-UHFFFAOYSA-N

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1 of 4

This Item
232777P353168.20825
Thioanisole ReagentPlus®, ≥99%

T28002

Thioanisole

2-(Phenylthio)ethanol 99%

232777

2-(Phenylthio)ethanol

Diphenyl sulfide 98%

P35316

Diphenyl sulfide

Methyl phenyl sulfide for synthesis

8.20825

Methyl phenyl sulfide

Quality Level

200

Quality Level

-

Quality Level

-

Quality Level

200

mp

−15 °C (lit.)

mp

-

mp

−40 °C (lit.)

mp

-17 °C

density

1.057 g/mL at 20 °C (lit.)

density

1.143 g/mL at 25 °C (lit.)

density

1.113 g/mL at 20 °C (lit.)

density

1.05 g/cm3 at 20 °C

bp

188 °C (lit.)

bp

115-116 °C/2 mmHg (lit.)

bp

296 °C (lit.)

bp

188 °C/1013 hPa

refractive index

n20/D 1.587 (lit.)

refractive index

n20/D 1.592 (lit.)

refractive index

n20/D 1.6327 (lit.)

refractive index

-

Application

Thioanisole may be used in the synthesis of methyl phenyl sulfoxide via oxidation.

Legal Information

ReagentPlus is a registered trademark of Merck KGaA, Darmstadt, Germany

pictograms

Exclamation markEnvironment

signalword

Warning

Hazard Classifications

Aquatic Chronic 2 - Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1B

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

163.4 °F

flash_point_c

73 °C

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter


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Customers Also Viewed

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Mild and selective oxidation of sulfur compounds in trifluoroethanol: diphenyl disulfide and methyl phenyl sulfoxide.
Ravikumar KS, et al.
Organic Syntheses, 184-189 (2003)
Methyl phenyl sulfoxide.
Johnson CR & Keiser JE.
Organic Syntheses, 78-78 (1966)
Rémy Ricoux et al.
Organic & biomolecular chemistry, 7(16), 3208-3211 (2009-07-31)
Two new artificial hemoproteins or "hemozymes", obtained by non covalent insertion of Fe(III)-meso-tetra-p-carboxy- and -p-sulfonato-phenylporphyrin into xylanase A from Streptomyces lividans, were characterized by UV-visible spectroscopy and molecular modeling studies, and were found to catalyze the chemo- and stereoselective oxidation
Jiyun Park et al.
Journal of the American Chemical Society, 133(14), 5236-5239 (2011-03-18)
The mechanism of sulfoxidation of thioaniosoles by a non-heme iron(IV)-oxo complex is switched from direct oxygen transfer to metal ion-coupled electron transfer by the presence of Sc(3+). The switch in the sulfoxidation mechanism is dependent on the one-electron oxidation potentials
Chun Zhu et al.
Physical chemistry chemical physics : PCCP, 14(37), 12800-12806 (2012-08-10)
The electronic and structural features of (oxo)manganese(V) corroles and their catalyzed oxygen atom transfers to thioanisole in different spin states have been investigated by the B3LYP functional calculations. Calculations show that these corrole-based oxidants and their complexes with thioanisole generally

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