1-Chloro-2-(trichloromethyl)benzene

Basic Information

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CAS Number

2136-89-2

Molecular Formula

C7H4Cl4

Molecular Weight

229.92 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

29-31 °C

Boiling Point

260-264 °C

Refractive Index

n20/D 1.583(lit.)

SMILES

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C1=CC=C(C(=C1)C(Cl)(Cl)Cl)Cl

InChI

InChI=1S/C7H4Cl4/c8-6-4-2-1-3-5(6)7(9,10)11/h1-4H

InChIKey

MFHPYLFZSCSNST-UHFFFAOYSA-N

LogP

4.1667000000000005

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

129

Safety Information

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GHS Hazard Pictograms

H314

Hazard Statement

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Sensitiveness

Moisture Sensitive

Synonyms & References

English

2136-89-2
.alpha.,.alpha.,.alpha.,2-Tetrachlorotoluene
2-Chlorobenzotrichloride, 96%
Benzene, 1-chloro-2-(trichloromethyl)-
F8889-2713
2-CHLOROBENZOTRICHLORIDE
SCHEMBL197704
NSC 59736
1-chloro-2-(trichloro-methyl)benzene
EINECS 218-377-7
Benzene, chloro(trichloromethyl)-
1-chloranyl-2-(trichloromethyl)benzene
Toluene, o,.alpha.,.alpha.,.alpha.-tetrachloro-
NSC-59736
F71283
Toluene, alpha,alpha,alpha,ar-tetrachloro-
(2-Chlorophenyl)trichlormethane
NS00006172
alpha,alpha,alpha,2-Tetrachlorotoluene
alpha,alpha,alpha-2-Tetrachlorotoluene
.alpha.,.alpha.,2-Tetrachlorotoluene
1-Chloro-2-(trichloromethyl)benzene
alpha,alpha,alpha,ar-Tetrachlorotoluene
W-107560
o-Chlorophenyltrichloromethane
EN300-20534
o-Chlorobenzylidyne chloride
Toluene, o,alpha,alpha,alpha-tetrachloro-
InChI=1/C7H4Cl4/c8-6-4-2-1-3-5(6)7(9,10)11/h1-4
31259-91-3
NSC59736

MDL Number

MFCD00000788

Customs Code

2903999090

FAQ

What is 1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2)?

1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2) is a chlorinated aromatic compound with the molecular formula C8H5Cl3. It is a colorless liquid with a high boiling point and low solubility in water. This compound is known for its stability under standard conditions and is commonly used as an intermediate in organic synthesis due to its reactivity and functional group versatility.

What are the main uses of 1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2)?

1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2) is primarily used in pharmaceuticals for synthesizing agrochemicals and specialty chemicals. It serves as a key intermediate in the production of pesticides, dyes, and other industrial compounds. Additionally, it is employed in research for developing new materials and in chemical synthesis for creating derivatives with tailored properties.

Is 1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2) safe?

1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2) requires careful handling due to potential toxicity. It may irritate the skin, eyes, and respiratory system, so protective measures like gloves, goggles, and ventilation are essential. Safety standards emphasize avoiding ingestion and ensuring proper storage to prevent exposure, adhering to OSHA guidelines for hazardous chemical use.

How should 1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2) be stored?

1-Chloro-2-(trichloromethyl)benzene (CAS: 2136-89-2) should be stored in a cool, dry, and well-ventilated area, away from direct light. Use airtight containers made of glass or HDPE to prevent evaporation and contamination. Maintain storage temperatures below 25°C and avoid humidity to ensure stability. Keep it separate from incompatible substances to prevent chemical reactions.