4-Chloro-2-(trifluoromethyl)aniline

Basic Information

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CAS Number

445-03-4

Molecular Formula

C7H5ClF3N

Molecular Weight

195.57 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

8.8 ºC

Boiling Point

77°C/5mmHg

Refractive Index

n20/D 1.507(lit.)

SMILES

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C1=CC(=C(C=C1Cl)C(F)(F)F)N

InChI

InChI=1S/C7H5ClF3N/c8-4-1-2-6(12)5(3-4)7(9,10)11/h1-3H,12H2

InChIKey

CVINWVPRKDIGLL-UHFFFAOYSA-N

LogP

2.9410000000000007

Topological Polar Surface Area

26.02 Å²

Hydrogen Bond Donor/Acceptor

2 / 1

Complexity

159

Safety Information

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GHS Hazard Pictograms

H302

H312

H315

H319

H332

H335

H373

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

H373 Causes damage to organs through prolonged or repeated exposure
Specific target organ toxicity, repeated exposure

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

AKOS000119431
FA1-1
AC-10155
4-Chloro-2-(trifluoromethyl)aniline
2-Amino-5-chlorobenzotrifluoride
A1058
PS-8283
EINECS 207-151-3
5-Chloro-2-aminobenzotrifluoride
Diazo Fast Scarlet VD
4-Chloro-a,a,a-trifluoro-o-toluidine
AM20060251
4-Chloro-alpha,alpha,alpha-trifluoro-o-toluidine
2-amino-5-chloro-trifluorotoluene
4-Chloro-.alpha.,.alpha.,.alpha.-trifluoro-o-toluidine
2-Amino-5-chlorobenzo trifluoride
4-Chloro-2-trifluoromethylaniline
MFCD00007841
SCHEMBL184916
CS-W010616
BP-20463
Aniline, 4-chloro-2-trifluoromethyl-
C.I. 37055
W-106192
445-03-4
o-Toluidine, 4-chloro-.alpha.,.alpha.,.alpha.-trifluoro-
4-chloro-2-trifluoromethyl-aniline
Scarlet Salt NVD
Fast Scarlet VD Salt
Benzenamine, 4-chloro-2-(trifluoromethyl)-
DTXSID6060000

MDL Number

MFCD00007841

Customs Code

2921420090

FAQ

What is 4-Chloro-2-(trifluoromethyl)aniline (CAS: 445-03-4)?

4-Chloro-2-(trifluoromethyl)aniline is an organic compound with the chemical formula C7H6ClF3N. It is a substituted aniline derivative containing both chlorine and trifluoromethyl groups. This compound is known for its aromatic structure and is commonly used in chemical synthesis due to its reactivity and functional group versatility.

What are the main uses of 4-Chloro-2-(trifluoromethyl)aniline (CAS: 445-03-4)?

4-Chloro-2-(trifluoromethyl)aniline is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in the synthesis of agrochemicals and specialty chemicals. Its unique fluorinated and chlorinated substituents make it valuable in creating compounds with specific biological and chemical properties.

Is 4-Chloro-2-(trifluoromethyl)aniline (CAS: 445-03-4) safe?

4-Chloro-2-(trifluoromethyl)aniline is considered hazardous and should be handled with care. It may cause skin and eye irritation, and its vapors can be harmful if inhaled. Safety protocols include proper ventilation, protective gloves, and eye protection. It is classified under hazardous chemicals and should comply with relevant safety standards in storage and use.

How should 4-Chloro-2-(trifluoromethyl)aniline (CAS: 445-03-4) be stored?

4-Chloro-2-(trifluoromethyl)aniline should be stored in a cool, dry, and well-ventilated place, away from light and moisture. It is best kept in a sealed container made of inert material such as glass or polyethylene. Storage conditions should maintain a temperature below 25°C and avoid exposure to air or heat to ensure stability and safety.