CAS 654-70-6

4-Amino-2-(trifluoromethyl)benzonitrile

Description:

4-Amino-2-(trifluoromethyl)benzonitrile, with the CAS number 654-70-6, is an organic compound characterized by the presence of an amino group and a trifluoromethyl group attached to a benzene ring that also contains a nitrile functional group. This compound typically appears as a solid and is known for its aromatic properties due to the benzene structure. The trifluoromethyl group contributes to its unique electronic properties, enhancing its reactivity and making it useful in various chemical applications, including pharmaceuticals and agrochemicals. The amino group can participate in hydrogen bonding, influencing the compound's solubility and interaction with other molecules. Additionally, the nitrile group imparts polarity, which can affect the compound's behavior in different solvents. Overall, 4-Amino-2-(trifluoromethyl)benzonitrile is notable for its potential applications in synthetic chemistry and material science, where its distinct functional groups can be leveraged for various chemical transformations.

Formula: C₈H₅F₃N₂

InChI: InChI=1S/C8H5F3N2/c9-8(10,11)7-3-6(13)2-1-5(7)4-12/h1-3H,13H2

InChI key: InChIKey=PMDYLCUKSLBUHO-UHFFFAOYSA-N

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

Synonyms:

• 1-Methoxy-4-Nitro-2-(Trifluoromethyl)Benzene
• 2-Cyano-5-Aminobenzotrifluoride
• 2-Trifluoromethyl-4-aminobenzonitrile
• 2-Trifuloromethyl-4-Aminobenzonitrile
• 4-Amino 2-Trifluoromethyl Benzonitrile
• 4-Amino-2-(Trifluoromethyl)Benzontrile
• 4-Amino-2-trifluoromethylbenzonitrile
• 4-Amino-α,α,α-trifluoro-o-tolunitrile
• 4-Cyano-3-Trifluoromethyl Aniline
• 4-Cyano-3-trifluoromethylaniline
• 5-Amino-2-Cyano Benzotrifluorid
• 5-Amino-2-cyanobenzotrifluoride
• Benzonitrile, 4-amino-2-(trifluoromethyl)-
• Buttpark 22\01-63

5-Amino-2-cyanobenzotrifluoride

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Purity: >98.0%(GC)

Color and Shape: White to Brown powder to crystal

Molecular weight: 186.14

Ref: 3B-A1213

4-Amino-2-(trifluoromethyl)benzonitrile, 97%

CAS: 654-70-6

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: C₈H₅F₃N₂

Purity: 97%

Color and Shape: White to cream to brown, Powder or lumps or fused solid or granules

Molecular weight: 186.14

Ref: 02-L12346

Bicalutamide impurity D

CAS: 654-70-6

Bicalutamide impurity D

Formula: C₁₂H₈N₂O

Color and Shape: Off-White

Molecular weight: 196.2047

Ref: 47-1116

4-Cyano-3-trifluoromethylaniline

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 186.1339

Ref: IN-DA003HYG

4-Amino-2-(trifluoromethyl)benzonitrile

CAS: 654-70-6

4-Amino-2-(trifluoromethyl)benzonitrile

Formula: C₈H₅F₃N₂

Purity: 98%

Color and Shape: white solid

Molecular weight: 186.13g/mol

Ref: 54-PC1070L

Bicalutamide EP Impurity D

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Color and Shape: White To Off-White Solid

Molecular weight: 186.14

Ref: 4Z-B-0219

4-Amino-2-trifluoromethylbenzonitrile

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Molecular weight: 186.14

Ref: 7W-GK9110

Bicalutamide EP Impurity D

Controlled Product

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Color and Shape: Neat

Molecular weight: 186.13

Ref: 86-MM0894.05

5-Amino-2-cyanobenzotrifluoride

Controlled Product

CAS: 654-70-6

Impurity Bicalutamide EP Impurity D
Applications 5-Amino-2-cyanobenzotrifluoride (Bicalutamide EP Impurity D) is used for the preparation of benzene derivatives as non-steroidal androgen receptor modulators.
References Xiao, H.-Y., et al.: Bioorg. Med. Chem. Lett., 20, 4491 (2010),

Formula: C₈H₅F₃N₂

Color and Shape: Off-White

Molecular weight: 186.13

Ref: TR-A603630

Bicalutamide EP Impurity D

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Molecular weight: 186.13

Ref: ST-EA-CP-B12004

5-Amino-2-cyanobenzotrifluoride

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 186.137

Ref: 10-F003971

4-Amino-2-(trifluoromethyl)benzonitrile

CAS: 654-70-6

Nilutamide is a drug that belongs to the class of acylation agents. It is used for the treatment of prostate cancer. Nilutamide binds to and inhibits the function of androgen receptors in prostate cancer cells, which prevents the synthesis of testosterone. This results in the death of prostate cancer cells by inhibiting cell growth and triggering apoptosis. It has been shown that nilutamide has a low bioavailability when administered orally, but can be detected in vivo using a model based on human tissues. The molecule was found to have high affinity for fatty acids, which may explain its ability to bind with phospholipids in membranes and inhibit cell proliferation.

Formula: C₈H₅F₃N₂

Purity: (1H-Nmr) Min. 95 Area-%

Color and Shape: Powder

Molecular weight: 186.13 g/mol

Ref: 3D-FA14802

Enzalutamide Impurity 34

CAS: 654-70-6

Formula: C₈H₅F₃N₂

Molecular weight: 186.10

Ref: ST-EA-CP-E16059