2-Methyl-3-(trifluoromethyl)aniline

Basic Information

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CAS Number

54396-44-0

Molecular Formula

C8H8F3N

Molecular Weight

175.15 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

38-42 °C

Boiling Point

203°C at 760 mmHg

Density

1.292

Refractive Index

1.38

SMILES

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CC1=C(C=CC=C1N)C(F)(F)F

InChI

InChI=1S/C8H8F3N/c1-5-6(8(9,10)11)3-2-4-7(5)12/h2-4H,12H2,1H3

InChIKey

TWLDBACVSHADLI-UHFFFAOYSA-N

LogP

2.59602

Topological Polar Surface Area

26.02 Å²

Hydrogen Bond Donor/Acceptor

2 / 1

Complexity

155

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

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

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

CL8400
DTXSID9057769
2-METHYL-3-AMINOBENZOTRIFLUORIDE
3-Amino-2-methylbenzotrifluoride
SR-01000944805-1
2-methyl-3-aminobenzo-trifluoride
Flunixin impurity B, European Pharmacopoeia (EP) Reference Standard
3-(Trifluoromethyl)-o-toluidine
TWLDBACVSHADLI-UHFFFAOYSA-
2-Methyl-3-trifluoromethylaniline
Benzenamine, 2-methyl-3-(trifluoromethyl)-
Flunixin impurity B
SY020386
W-105631
2-methyl-3-(trifluromethyl)aniline
EINECS 259-145-5
AM20060332
2-Methyl-3-(trifluoromethyl)aniline, 95%
HY-W002448
PS-8607
Tox21_113763
2-methyl-3-(trifluoromethyl)benzenamine
CHEMBL3186056
569607266B
3-(trifluoromethyl)-2-methylbenzenamine
FLUNIXIN MEGLUMINE IMPURITY B [EP IMPURITY]
M1328
2-methyl-3-trifluoromethyl-phenylamine
2-Methyl-3-(trifluoromethyl)aniline
SCHEMBL330603
AKOS005257844

MDL Number

MFCD00153216

Customs Code

2921430090

FAQ

What is 2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0)?

2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0) is an aromatic amine with the chemical formula C8H9NF3. It features a benzene ring substituted with a methyl group and a trifluoromethyl group, making it a valuable compound in organic chemistry. This substance is typically a liquid with moderate solubility in organic solvents and exhibits stability under standard conditions, though its reactivity may vary depending on environmental factors.

What are the main uses of 2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0)?

2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0) is primarily used as an intermediate in pharmaceuticals, particularly in the synthesis of agrochemicals and medicinal compounds. Its trifluoromethyl group enhances chemical stability and biological activity, making it relevant in drug development. It also finds applications in industrial processes, research, and specialty chemical formulations requiring fluorinated structures.

Is 2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0) safe?

2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0) requires careful handling due to potential toxicity. It may cause skin and eye irritation, and prolonged exposure could lead to respiratory issues. Safety standards emphasize the use of personal protective equipment (PPE) like gloves and goggles, along with proper ventilation. Always follow guidelines from OSHA or chemical safety data sheets (SDS) for safe use.

How should 2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0) be stored?

2-Methyl-3-(trifluoromethyl)aniline (CAS: 54396-44-0) should be stored in a tightly sealed container in a cool, dry, and dark place. Maintain storage at temperatures below 25°C to prevent degradation. Avoid exposure to moisture and incompatible materials. Ensure proper labeling and keep away from heat sources to maintain stability and safety.