CymitQuimica logo

CAS 951886-97-8

:

Ethyl 2-chloro-4-(methylthio)-ζ-oxobenzeneheptanoate

Description:
Ethyl 2-chloro-4-(methylthio)-ζ-oxobenzeneheptanoate, with the CAS number 951886-97-8, is a chemical compound that belongs to the class of esters. It features a complex structure characterized by the presence of a chloro group, a methylthio group, and an oxobenzene moiety, which contribute to its unique chemical properties. The compound is likely to exhibit moderate to high lipophilicity due to the presence of the ethyl ester and aromatic components, which can influence its solubility in organic solvents. Additionally, the presence of the chlorine atom may impart specific reactivity, making it a potential candidate for various chemical reactions, including nucleophilic substitutions. The methylthio group can also affect the electronic properties of the molecule, potentially enhancing its reactivity or altering its interaction with biological systems. Overall, this compound may have applications in organic synthesis, medicinal chemistry, or as an intermediate in the production of other chemical entities, although specific applications would depend on further research and characterization.
Formula:C16H21ClO3S
InChI:InChI=1S/C16H21ClO3S/c1-3-20-16(19)8-6-4-5-7-15(18)13-10-9-12(21-2)11-14(13)17/h9-11H,3-8H2,1-2H3
InChI key:InChIKey=BUKOPJMMKQGXCC-UHFFFAOYSA-N
SMILES:C(CCCCCC(OCC)=O)(=O)C1=C(Cl)C=C(SC)C=C1
Synonyms:
  • Ethyl 2-chloro-4-(methylthio)-ζ-oxobenzeneheptanoate
  • Benzeneheptanoic acid, 2-chloro-4-(methylthio)-ζ-oxo-, ethyl ester
Sort by
Purity (%)
0
100
|
0
|
50
|
90
|
95
|
100
Found 1 products.