CAS 898767-80-1
:2-Chloro-ζ-oxobenzeneheptanenitrile
Description:
2-Chloro-ζ-oxobenzeneheptanenitrile, identified by its CAS number 898767-80-1, is a chemical compound that features a complex structure characterized by the presence of a chloro group, a nitrile functional group, and a ketone moiety. The compound is likely to exhibit properties typical of nitriles, such as being polar and having a relatively high boiling point compared to non-polar compounds of similar molecular weight. The chloro substituent can influence its reactivity, making it more susceptible to nucleophilic attack. Additionally, the presence of the aromatic benzene ring contributes to its stability and can affect its solubility in various solvents. This compound may be of interest in synthetic organic chemistry and could potentially serve as an intermediate in the synthesis of more complex molecules. Its specific applications and reactivity would depend on the functional groups present and the overall molecular structure, which can dictate its behavior in chemical reactions. Safety data and handling precautions should be consulted due to the potential hazards associated with halogenated compounds and nitriles.
Formula:C13H14ClNO
InChI:InChI=1S/C13H14ClNO/c14-12-8-5-4-7-11(12)13(16)9-3-1-2-6-10-15/h4-5,7-8H,1-3,6,9H2
InChI key:InChIKey=NNZRTMBDBCFQSP-UHFFFAOYSA-N
SMILES:C(CCCCCC#N)(=O)C1=C(Cl)C=CC=C1
Synonyms:- Benzeneheptanenitrile, 2-chloro-ζ-oxo-
- 2-Chloro-ζ-oxobenzeneheptanenitrile
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