V900262
Thioanisole
Vetec™, reagent grade, 98%
Synonym(s):
Methyl phenyl sulfide
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About This Item
Linear Formula:
C6H5SCH3
CAS Number:
Molecular Weight:
124.20
EC Number:
202-878-2
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
1904179
MDL number:
Assay:
98%
InChI key
HNKJADCVZUBCPG-UHFFFAOYSA-N
InChI
1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,1H3
SMILES string
CSc1ccccc1
grade
reagent grade
product line
Vetec™
assay
98%
refractive index
n20/D 1.587 (lit.)
bp
188 °C (lit.)
mp
−15 °C (lit.)
density
1.057 g/mL at 20 °C (lit.)
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Legal Information
Vetec is a trademark of Merck KGaA, Darmstadt, Germany
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Warning
hcodes
Hazard Classifications
Aquatic Chronic 2 - Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1B
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
156.2 °F - closed cup
flash_point_c
69 °C - closed cup
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Yoshihiro Yamakita et al.
The journal of physical chemistry. A, 112(47), 12220-12227 (2008-11-05)
Nonresonant Raman spectra and conformational stability are studied for thioanisole (TA) and substituted analogues [4-XTA, X = NO(2) (1), CN (2), H (3), CH(3) (4), and NH(2) (5)] at the 4-position. The ring-substituent (SCH(3)) vibrational modes of out-of-plane bending and
Jeong Sik Lim et al.
Nature chemistry, 2(8), 627-632 (2010-07-24)
Chemical reactions that occur in the ground electronic state are described well by invoking the Born-Oppenheimer approximation, which allows their development to be rationalized by nuclear rearrangements that smoothly traverse an adiabatic potential energy surface. The situation is different, however
Yunho Lee et al.
Inorganic chemistry, 49(19), 8873-8885 (2010-09-09)
To better understand the effect of thioether coordination in copper-O(2) chemistry, the tetradentate N(3)S ligand L(ASM) (2-(methylthio)-N,N-bis((pyridin-2-yl)methyl)benzenamine) and related alkylether ligand L(EOE) (2-ethoxy-N,N-bis((pyridin-2-yl)methyl)ethanamine) have been studied. The corresponding copper(I) complexes, [(L(ASM))Cu(I)](+) (1a) and [(L(EOE))Cu(I)](+) (3a), were studied as were the
Hai-Min Shen et al.
Carbohydrate research, 354, 49-58 (2012-05-01)
Inspired by β-CD, a macrocyclic oligomers of D-(+)-glucopyranose and a renewable material, which could be obtained from starch, that can promote a lot of organic reactions in water, a green solvent, several amino alcohol-modified β-CDs CD-1 to CD-7 were synthesized
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
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