CAS 3288-99-1

Butylphenylacetonitrile

Description:

Butylphenylacetonitrile, with the CAS number 3288-99-1, is an organic compound characterized by its structure, which includes a butyl group, a phenyl group, and a nitrile functional group. This compound typically appears as a colorless to pale yellow liquid and is known for its relatively low volatility and moderate solubility in organic solvents. It is often utilized in organic synthesis and may serve as an intermediate in the production of various pharmaceuticals and agrochemicals. The presence of the nitrile group imparts certain reactivity, making it a useful building block in chemical reactions, such as nucleophilic additions. Additionally, butylphenylacetonitrile may exhibit specific physical properties, including a distinct boiling point and density, which are important for its handling and application in laboratory settings. Safety data sheets should be consulted for information regarding its toxicity and handling precautions, as with many organic compounds. Overall, butylphenylacetonitrile is a versatile compound with applications in various chemical processes.

Formula: C₁₂H₁₅N

InChI: InChI=1/C12H15N/c1-12(2,3)11-6-4-10(5-7-11)8-9-13/h4-7H,8H2,1-3H3

InChI key: InChIKey=QKJPXROEIJPNHG-UHFFFAOYSA-N

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

Synonyms:

• (p-tert-Butylphenyl)acetonitrile
• 2-(4-tert-Butylphenyl)acetonitrile
• 2-[4-(Tert-Butyl)Phenyl]Ethanenitrile
• 4-(1,1-Dimethylethyl)-Benzeneacetonitril
• 4-(1,1-Dimethylethyl)benzeneacetonitrile
• 4-(Tert-Butyl)Benzyl Cyanide
• 4-Butylphenylacetonitrile
• 4-Tert-Butylphenyl-Acetonitril
• 4-Tert-Butylphenyl-Acetonitrile
• 4-Tert-Butylphenylacetonitrile
• 4-tert-Butylbenzyl cyanide
• Acetonitrile, (p-tert-butylphenyl)-
• Benzeneacetonitrile, 4-(1,1-dimethylethyl)-
• NSC 85354
• P-Tert-Butylbenzylcyanide
• P-Tert-Butylphenylacetonitrile
• p-tert-Butylbenzyl cyanide
• 4-(tert-butyl)phenylacetonitrile
• Butylphenylacetonitrile
• 4-tert-Butylbenzeneacetonitrile

4-tert-Butylphenylacetonitrile

CAS: 3288-99-1

Formula: C₁₂H₁₅N

Purity: >98.0%(GC)

Color and Shape: Colorless to Almost colorless clear liquid

Molecular weight: 173.26

Ref: 3B-B5935

2-(4-(tert-Butyl)phenyl)acetonitrile

CAS: 3288-99-1

Formula: C₁₂H₁₅N

Purity: 95%

Color and Shape: Liquid

Molecular weight: 173.2542

Ref: IN-DA003M2B

4-(tert-Butyl)phenylacetonitrile

CAS: 3288-99-1

4-(tert-Butyl)phenylacetonitrile

Formula: C₁₂H₁₅N

Purity: 98%

Color and Shape: light yellow liquid

Molecular weight: 173.25g/mol

Ref: 54-OR6530

4-tert-Butylbenzylcyanide

CAS: 3288-99-1

4-tert-Butylbenzylcyanide is a synthetic reagent that is used for the synthesis of ethylene, which is an important chemical in the petrochemical industry. 4-tert-Butylbenzylcyanide can be prepared by a transesterification reaction between alcohols and acetic acid, followed by carbonation. 4-tert-Butylbenzylcyanide has been shown to react with molecular oxygen in solution to form a carbonyl group and fluorescence. This reaction was optimized using molecular orbital theory and localization of electron density.

Formula: C₁₂H₁₅N

Purity: Min. 95%

Color and Shape: Clear Liquid

Molecular weight: 173.25 g/mol

Ref: 3D-FB70688

2-[4-(tert-Butyl)phenyl]ethanenitrile

CAS: 3288-99-1

Formula: C₁₂H₁₅N

Purity: 98%

Color and Shape: Liquid

Molecular weight: 173.259

Ref: 10-F078846

2-(4-tert-Butylphenyl)acetonitrile

Controlled Product

CAS: 3288-99-1

Applications 2-(4-tert-Butylphenyl)acetonitrile has been used in the study of cancer by focusing on inhibiting Akt1 and SCD1
References Imamura, Keisuke, et al.: Bioorganic & Medicinal Chem, 25(14), 3768-3779, (2017). Liu, Yang, et al.: European Journal of Medicinal Chemistry, 138, 543-551, (2017)

Formula: C₁₂H₁₅N

Color and Shape: Neat

Molecular weight: 173.25

Ref: TR-B694435