CAS 4210-32-6

4-(1,1-Dimethylethyl)benzonitrile

Description:

4-(1,1-Dimethylethyl)benzonitrile, also known as tert-butyl benzonitrile, is an organic compound characterized by a benzonitrile structure with a tert-butyl group attached to the para position of the benzene ring. This compound typically appears as a colorless to pale yellow liquid or solid, depending on the temperature and purity. It is known for its relatively low solubility in water but is soluble in organic solvents such as ethanol and acetone. The presence of the nitrile functional group (-C≡N) imparts certain chemical reactivity, making it useful in various synthetic applications, including as an intermediate in organic synthesis. Additionally, the tert-butyl group contributes to the compound's steric hindrance, which can influence its reactivity and interactions with other molecules. 4-(1,1-Dimethylethyl)benzonitrile is utilized in the production of pharmaceuticals, agrochemicals, and other specialty chemicals, highlighting its importance in industrial chemistry. Safety data should be consulted for handling and storage, as with any chemical substance.

Formula: C₁₁H₁₃N

InChI: InChI=1/C11H13N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h4-7H,1-3H3

InChI key: InChIKey=IIZURLNRIMKEDL-UHFFFAOYSA-N

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

Synonyms:

• 1-Cyano-4-(tert-butyl)benzene
• 4-(1,1-Dimethylethyl)benzonitrile
• 4-(Tert-Butyl)Benzonitrile
• 4-t-Butylbenzonitrile
• Benzonitrile, 4-(1,1-dimethylethyl)-
• Benzonitrile, p-tert-butyl-
• Ncr Dx1&1&1 [Wln]
• p-tert-Butylbenzonitrile
• 4-tert-Butylbenzonitrile
• 4-tert-Butylbenzonitrile 97%
• P-T-BUTYLBENZONITRILE
• 4-tert-Butylbenzonitrile, 98+%

4-tert-Butylbenzonitrile

CAS: 4210-32-6

Formula: C₁₁H₁₃N

Purity: >98.0%(GC)

Color and Shape: Colorless to Light yellow clear liquid

Molecular weight: 159.23

Ref: 3B-B1576

4-tert-Butylbenzonitrile, 98+%

CAS: 4210-32-6

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: C₁₁H₁₃N

Purity: 98+%

Color and Shape: Clear colorless, Liquid

Molecular weight: 159.23

Ref: 02-A14076

4-(tert-Butyl)benzonitrile

CAS: 4210-32-6

Formula: C₁₁H₁₃N

Purity: 97%

Color and Shape: Liquid

Molecular weight: 159.2276

Ref: IN-DA00I86D

4-tert-Butylbenzonitrile

CAS: 4210-32-6

4-tert-Butylbenzonitrile

Formula: C₁₁H₁₃N

Purity: 98%

Color and Shape: colourless solid

Molecular weight: 159.23g/mol

Ref: 54-OR30168

4-tert-Butylbenzonitrile

CAS: 4210-32-6

Formula: C₁₁H₁₃N

Purity: 97%

Color and Shape: Liquid

Molecular weight: 159.232

Ref: 10-F018336