CAS 898766-10-4
:2-(2,2-Dimethyl-1-oxopropyl)benzonitrile
Description:
2-(2,2-Dimethyl-1-oxopropyl)benzonitrile, identified by its CAS number 898766-10-4, is an organic compound characterized by its structural features, which include a benzonitrile moiety and a substituent that contains a dimethyl-1-oxopropyl group. This compound typically exhibits properties common to nitriles, such as moderate polarity and the ability to participate in nucleophilic reactions due to the presence of the cyano group. The presence of the bulky dimethyl substituent can influence its steric and electronic properties, potentially affecting its reactivity and solubility in various solvents. Additionally, compounds like this may have applications in organic synthesis or as intermediates in the production of pharmaceuticals or agrochemicals. The specific physical properties, such as melting point, boiling point, and solubility, would need to be determined experimentally or sourced from reliable chemical databases, as they can vary based on purity and environmental conditions.
Formula:C12H13NO
InChI:InChI=1S/C12H13NO/c1-12(2,3)11(14)10-7-5-4-6-9(10)8-13/h4-7H,1-3H3
InChI key:InChIKey=SENZRNCWZAQBNT-UHFFFAOYSA-N
SMILES:C(C(C)(C)C)(=O)C1=C(C#N)C=CC=C1
Synonyms:- Benzonitrile, 2-(2,2-dimethyl-1-oxopropyl)-
- 2-(2,2-Dimethyl-1-oxopropyl)benzonitrile
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