CAS 898786-74-8
:3-(6-Chloro-1-oxohexyl)benzonitrile
Description:
3-(6-Chloro-1-oxohexyl)benzonitrile, identified by its CAS number 898786-74-8, is an organic compound characterized by its structural features, which include a benzonitrile moiety and a hexyl chain with a chloro and carbonyl functional group. This compound typically exhibits a solid state at room temperature and is likely to be sparingly soluble in water due to its hydrophobic characteristics, while being more soluble in organic solvents. The presence of the chloro group suggests potential reactivity, particularly in nucleophilic substitution reactions. The carbonyl group contributes to its reactivity, making it a candidate for various chemical transformations. Additionally, the nitrile functional group can participate in reactions such as hydrolysis or reduction, further expanding its utility in synthetic chemistry. Overall, this compound may be of interest in pharmaceutical research or material science due to its unique structural attributes and potential biological activity. Proper handling and safety measures should be observed, as with all chemical substances, to mitigate any risks associated with its use.
Formula:C13H14ClNO
InChI:InChI=1S/C13H14ClNO/c14-8-3-1-2-7-13(16)12-6-4-5-11(9-12)10-15/h4-6,9H,1-3,7-8H2
InChI key:InChIKey=NGXQNSABIMWNEN-UHFFFAOYSA-N
SMILES:C(CCCCCCl)(=O)C1=CC(C#N)=CC=C1
Synonyms:- Benzonitrile, 3-(6-chloro-1-oxohexyl)-
- 3-(6-Chloro-1-oxohexyl)benzonitrile
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