CAS 91373-91-0

Methyl 3-chloro-4-[(dimethylamino)thioxomethoxy]benzeneacetate

Description:

Methyl 3-chloro-4-[(dimethylamino)thioxomethoxy]benzeneacetate, identified by its CAS number 91373-91-0, is a chemical compound that features a complex structure characterized by a benzene ring substituted with various functional groups. The presence of a chloro group indicates potential reactivity, while the dimethylamino group suggests basic properties and possible interactions with nucleophiles. The thioxomethoxy moiety introduces sulfur into the structure, which can influence the compound's reactivity and solubility. As an ester, it may exhibit typical ester characteristics, such as volatility and susceptibility to hydrolysis. This compound may be of interest in medicinal chemistry or agricultural applications due to its unique functional groups, which could impart specific biological activities. However, detailed studies on its physical properties, such as solubility, melting point, and stability, as well as its biological effects, would be necessary to fully understand its potential applications and safety profile.

Formula: C₁₂H₁₄ClNO₃S

InChI: InChI=1S/C12H14ClNO3S/c1-14(2)12(18)17-10-5-4-8(6-9(10)13)7-11(15)16-3/h4-6H,7H2,1-3H3

InChI key: InChIKey=HZCREWCZSHSKKC-UHFFFAOYSA-N

SMILES: C(C(OC)=O)C1=CC(Cl)=C(OC(N(C)C)=S)C=C1

Synonyms:

• Methyl 3-chloro-4-[(dimethylamino)thioxomethoxy]benzeneacetate
• Benzeneacetic acid, 3-chloro-4-[(dimethylamino)thioxomethoxy]-, methyl ester
• (3-Chloro-4-dimethylthiocarbamoyloxyphenyl)acetic acid methyl ester