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Merck
CN

558001

Sigma-Aldrich

2-氯茴香硫醚

96%

别名:

2-氯苯甲硫醚

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About This Item

线性分子式:
ClC6H4SCH3
CAS号:
分子量:
158.65
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

方案

96%

折射率

n20/D 1.608 (lit.)

沸点

239-240 °C (lit.)

官能团

chloro
thioether

SMILES字符串

CSc1ccccc1Cl

InChI

1S/C7H7ClS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3

InChI key

IHLDFHCSSCVPQW-UHFFFAOYSA-N

一般描述

2-Chlorothioanisole can be prepared from the reaction between N,N-dimethylformamide, 1,2-dichlorobenzene, finely ground KOH and methyl mercaptan. Benzene dipole moment value analysis of 2-chlorothioanisole indicates that it exists predominantly in trans- form. 1H NMR spectrum of 2-chlorothioanisole has been studied in acetone-d6 solution.

应用

2-Chlorothioanisole may be used to synthesize 2-chlorophenyl methyl sulfone.

象形图

Exclamation mark

警示用语:

Warning

危险声明

危险分类

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

靶器官

Respiratory system

储存分类代码

10 - Combustible liquids

WGK

WGK 3

闪点(°F)

158.0 °F - closed cup

闪点(°C)

70 °C - closed cup

个人防护装备

Eyeshields, Gloves, type ABEK (EN14387) respirator filter


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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The preferred conformations of 2, 4-dichlorophenol, 2, 4-dichloroanisole and their sulphur analogues.
Lumbroso H, et al.
Journal of Molecular Structure, 43(1), 87-95 (1978)
Development of the Large-Scale Preparation of 2-(Methanesulfonyl) benzenesulfonyl Chloride.
Meckler H and Herr RJ.
Organic Process Research & Development, 16(4), 550-555 (2012)
The proximate coupling constant, 5 J (H, CH3), and the torsional mobility of the thiomethyl group in some thioanisole derivatives.
Schaefer T, et al.
Canadian Journal of Chemistry, 69(4), 620-624 (1991)
Analysis of chlorophenylmethylsulfides in the urine of rats injected with chlorobenzene by high performance liquid chromatography.
M Yoshida et al.
Industrial health, 23(4), 283-287 (1985-01-01)

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