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Merck
CN

525340

Sigma-Aldrich

4-氯-3-(三氟甲基)异硫氰酸苯酯

97%

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About This Item

线性分子式:
ClC6H3(CF3)NCS
CAS号:
分子量:
237.63
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:

方案

97%

折射率

n20/D 1.5905 (lit.)

沸点

248-251 °C (lit.)

密度

1.47 g/mL at 25 °C (lit.)

储存温度

2-8°C

SMILES字符串

FC(F)(F)c1cc(ccc1Cl)N=C=S

InChI

1S/C8H3ClF3NS/c9-7-2-1-5(13-4-14)3-6(7)8(10,11)12/h1-3H

InChI key

AHFPRSSHNSGRCU-UHFFFAOYSA-N

一般描述

4-Chloro-3-(trifluoromethyl)phenyl isothiocyanate is an aryl isothiocyanate. It can be synthesized from the corresponding aniline. Its freezing point is 308.15K. Enthalpy of vaporization of 4-chloro-3-(trifluoromethyl)phenyl isothiocyanate at boiling point (522.65K) is 46.065kjoule/mol.

应用

4-Chloro-3-(trifluoromethyl)phenyl isothiocyanate may be used to synthesize aminotetrazole derivative.

象形图

Corrosion

警示用语:

Danger

危险声明

危险分类

Eye Dam. 1 - Skin Corr. 1B

储存分类代码

8A - Combustible corrosive hazardous materials

WGK

WGK 3

闪点(°F)

230.0 °F - closed cup

闪点(°C)

110 °C - closed cup

个人防护装备

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

法规信息

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分析证书(COA)

Lot/Batch Number

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访问文档库

Yaws CL.
The Yaws Handbook of Physical Properties for Hydrocarbons and Chemicals (2015)
Yaws CL.
Thermophysical Properties of Chemicals and Hydrocarbons, 548-548 (2014)
A highly efficient methodology for 5-methyl-3-aryl-2-thiooxazolidin-4-ones using lithium perchlorate in DIPEA mediated synthesis.
Khatik GL, et al.
Journal of Heterocyclic Chemistry, 47(3), 734-734 (2010)
Sara Van Poecke et al.
Bioorganic & medicinal chemistry, 19(24), 7603-7611 (2011-11-09)
We report on Mycobacterium tuberculosis thymidine monophosphate kinase (TMPKmt) inhibitory activities of a series of new 3'- and 5'-modified thymidine analogues including α- and β-derivatives. In addition, several analogues were synthesized in which the 4-oxygen was replaced by a more

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