CAS 461-82-5

4-(Trifluoromethoxy)aniline

Description:

4-(Trifluoromethoxy)aniline, with the CAS number 461-82-5, is an organic compound characterized by the presence of both an aniline group and a trifluoromethoxy substituent. This compound features a benzene ring with an amino group (-NH2) at the para position and a trifluoromethoxy group (-O-CF3) at the opposite para position. The trifluoromethoxy group imparts unique electronic properties, enhancing the compound's reactivity and solubility in various solvents. It is typically a solid at room temperature and may exhibit moderate to high stability under standard conditions. The presence of fluorine atoms contributes to its lipophilicity and potential biological activity, making it of interest in pharmaceutical and agrochemical research. Additionally, 4-(Trifluoromethoxy)aniline can participate in various chemical reactions, including nucleophilic substitutions and coupling reactions, which are valuable in synthetic organic chemistry. Safety precautions should be taken when handling this compound, as it may pose health risks if inhaled or ingested.

Formula: C₇H₆F₃NO

InChI: InChI=1S/C7H6F3NO/c8-7(9,10)12-6-3-1-5(11)2-4-6/h1-4H,11H2

InChI key: InChIKey=XUJFOSLZQITUOI-UHFFFAOYSA-N

SMILES: O(C(F)(F)F)C1=CC=C(N)C=C1

Synonyms:

• (4-(Trifluoromethoxy)phenyl)amine
• 1-Amino-4-(trifluoromethoxy)benzene
• 4-(Trifluoromethoxy)aniline
• 4-(Trifluoromethoxy)benzenamine
• 4-Trifluoromethoxybenzeneamine
• 4-[(Trifluoromethyl)oxy]aniline
• Benzenamine, 4-(trifluoromethoxy)-
• p-(Trifluoromethoxy)aniline
• p-Aminotrifluoromethoxybenzene
• p-Anisidine, α,α,α-trifluoro-
• p-Trifluoromethoxyphenylamine

4-(Trifluoromethoxy)aniline

CAS: 461-82-5

Formula: C₇H₆F₃NO

Purity: >98.0%(GC)(T)

Color and Shape: Colorless to Yellow to Orange clear liquid

Molecular weight: 177.13

Ref: 3B-T1345

4-(Trifluoromethoxy)aniline, 98%

CAS: 461-82-5

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Sci

Formula: C₇H₆F₃NO

Purity: 98%

Color and Shape: Liquid, Clear colorless to yellow or pale brown

Molecular weight: 177.13

Ref: 02-A17208

Riluzole Related Compound A (4-(Trifluoromethoxy)aniline)

CAS: 461-82-5

Amino-naphthols and other amino-phenols, their ethers and esters, other than those cont more than one kind of oxygen function; salts thereof nesoi

Formula: C₇H₆F₃NO

Color and Shape: Colorless Light Yellow Liquid

Molecular weight: 177.04015

Ref: 45-1604348

4-(Trifluoromethoxy)Aniline

CAS: 461-82-5

Formula: C₇H₆F₃NO

Purity: 98%

Color and Shape: Liquid

Molecular weight: 177.1238

Ref: IN-DA0033U0

Riluzole USP Related Compound A

CAS: 461-82-5

Formula: C₇H₆F₃NO

Color and Shape: White To Off-White Solid

Molecular weight: 177.13

Ref: 4Z-R-1423

4-Trifluoromethoxyaniline

CAS: 461-82-5

Formula: C₇H₆F₃NO

Purity: ≥ 98.0%

Color and Shape: Colourless to light-yellow liquid

Molecular weight: 177.13

Ref: 7W-GK2713

4-(Trifluoromethoxy)aniline

CAS: 461-82-5

4-(Trifluoromethoxy)aniline

Formula: C₇H₆F₃NO

Purity: 98%

Color and Shape: clear. yellow to brown liquid

Molecular weight: 177.12g/mol

Ref: 54-PC7434

4-(Trifluoromethoxy)aniline

Controlled Product

CAS: 461-82-5

Formula: C₇H₆F₃NO

Color and Shape: Neat

Molecular weight: 177.12

Ref: 04-C17844810

4-Trifluoromethoxyaniline

Controlled Product

CAS: 461-82-5

Formula: C₇H₆F₃NO

Color and Shape: Neat

Molecular weight: 177.12

Ref: 86-MM1382.01

4-(Trifluoromethoxy)aniline

CAS: 461-82-5

Formula: C₇H₆F₃NO

Purity: 98.0%

Color and Shape: Liquid

Molecular weight: 177.126

Ref: 10-F001400

Riluzole USP Related Compound A

CAS: 461-82-5

Formula: C₇H₆F₃NO

Molecular weight: 177.13

Ref: ST-EA-CP-R14001

4-(Trifluoromethoxy)aniline

Controlled Product

CAS: 461-82-5

Stability Hygroscopic
Applications 4-(Trifluoromethoxy)aniline is used in the synthesis of anticancer agents and antitumor medicaments. Also, its an intermediate in the production of labelled Riluzole (R510000), a neuroprotective agent. Modulates glutamatergic transmission. A glutamate release inhibitor. An anticonvulsant.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Cilibrizzi, A., et al.: J. Med. Chem., 52, 5044 (2009), Verhaeghe, P., et al.: Bioorg. Med. Chem., 17, 4313 (2009), Chandregowda, V., et al.: Eur. J. Med. Chem., 44, 3046 (2009), Wahl, F., et al.: Eur. J. Pharmacol., 230, 209 (1993) Bensimon, G., et al.: N. Engl. J. Med., 330, 585 (1994); Piras, S. et al.: Eur. j. Med. Chem., 75, 169 (2014); Vyas, V. et al.: Eur. J. Med. Chem., 82, 385 (2014);

Formula: C₇H₆F₃NO

Color and Shape: Neat

Molecular weight: 177.12

Ref: TR-T790700

4-(Trifluoromethoxy)aniline

CAS: 461-82-5

4-(Trifluoromethoxy)aniline is a reactive intermediate used in the synthesis of pharmaceuticals, dyes, and pesticides. It is prepared by reacting hydrogen fluoride with aniline in the presence of an acid catalyst. 4-(Trifluoromethoxy)aniline can be used to synthesize epoxyeicosatrienoic acids, which are potent anti-inflammatory agents. 4-(Trifluoromethoxy)aniline has been shown to have a pharmacokinetic profile that is similar to those of other fluoroquinolones, but has not been studied for clinical development.

Formula: C₇H₆F₃NO

Purity: Min. 95%

Color and Shape: Clear Liquid

Molecular weight: 177.12 g/mol

Ref: 3D-FT38100