1,2,3-Trichloro-5-(trifluoromethyl)benzene

Basic Information

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CAS Number

50594-82-6

Molecular Formula

C7H2Cl3F3

Molecular Weight

249.45 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

-6°C

Boiling Point

113°C/50mmHg

Flash Point

98 ºC

Refractive Index

1.498-1.501

SMILES

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C1=C(C=C(C(=C1Cl)Cl)Cl)C(F)(F)F

InChI

InChI=1S/C7H2Cl3F3/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2H

InChIKey

FBKFIAIRSQOXJR-UHFFFAOYSA-N

LogP

4.6656

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

170

Safety Information

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GHS Hazard Pictograms

H315

H319

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

DTXSID00198633
EINECS 256-636-6
AC-11802
3,4,5-Trichlorobenzotrifluoride
A7503
3,4,5-trichloro-alpha,alpha,alpha-triflurotoluene
CS-W012655
3,4,5-trichloro-benzotrifluoride
W-105945
50594-82-6
1-trifluoromethyl-3,4,5-trichlorobenzene
88UV3JQC3W
NS00005972
3,4,5-trichloro trifluoromethyl benzene
3,4,5-trichloro-alpha,alpha,alpha--trifluorotoluene
T2281
InChI=1/C7H2Cl3F3/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2
MFCD00035985
AS-12623
CK2381
1,2,3-Trichloro-5-(trifluoromethyl)benzene
FT-0614130
EC 256-636-6
AKOS009031528
EN300-19635
3,4,5-TRICHLORO-ALPHA,ALPHA,ALPHA-TRIFLUOROTOLUENE
1,2,3-trichloro-5-(trifluoromethyl)benzene;3,4,5-Trichlorobenzotrifluoride
SY050127
C7H2Cl3F3
SCHEMBL981089
Benzene, 1,2,3-trichloro-5-(trifluoromethyl)-

MDL Number

MFCD00035985

Customs Code

2903999090

FAQ

What is 1,2,3-Trichloro-5-(trifluoromethyl)benzene (CAS: 50594-82-6)?

1,2,3-Trichloro-5-(trifluoromethyl)benzene is a colorless or white crystalline solid. It has a molecular formula of C8H2Cl3F3 and is used in various industrial applications. It is a dense, non-volatile compound with a high melting point.

What are the main uses of 1,2,3-Trichloro-5-(trifluoromethyl)benzene (CAS: 50594-82-6)?

1,2,3-Trichloro-5-(trifluoromethyl)benzene is primarily used in the synthesis of pharmaceuticals, dyes, and as a solvent in organic chemistry. It is also used in the production of rubber chemicals and flame retardants.

Is 1,2,3-Trichloro-5-(trifluoromethyl)benzene (CAS: 50594-82-6) safe?

1,2,3-Trichloro-5-(trifluoromethyl)benzene is not considered safe for human exposure. It is a toxic compound and can cause skin and respiratory irritation. Proper safety measures, including personal protective equipment, should be used when handling this chemical.

How should 1,2,3-Trichloro-5-(trifluoromethyl)benzene (CAS: 50594-82-6) be stored?

1,2,3-Trichloro-5-(trifluoromethyl)benzene should be stored in a cool, dry, and well-ventilated area. It should be kept away from heat sources, direct sunlight, and oxidizing agents. The containers should be tightly sealed and stored in a secure, clearly labeled container to prevent accidental exposure.