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CAS 117428-51-0

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Methyl (αE)-2-(chloromethyl)-α-(methoxymethylene)benzeneacetate

Description:
Methyl (αE)-2-(chloromethyl)-α-(methoxymethylene)benzeneacetate, with the CAS number 117428-51-0, is an organic compound characterized by its complex structure, which includes a benzene ring substituted with various functional groups. This compound features a chloromethyl group and a methoxymethylene moiety, contributing to its reactivity and potential applications in organic synthesis. The presence of the ester functional group (acetate) indicates that it can undergo hydrolysis, making it relevant in reactions involving nucleophiles. Its stereochemistry, denoted by the (αE) configuration, suggests specific spatial arrangements that can influence its chemical behavior and interactions. This compound may exhibit properties typical of aromatic esters, such as moderate volatility and solubility in organic solvents. Additionally, its chloromethyl group can serve as a site for further chemical modifications, making it a valuable intermediate in the synthesis of more complex molecules. Overall, this compound's unique structure and functional groups position it as a noteworthy subject of study in organic chemistry and potential applications in pharmaceuticals or agrochemicals.
Formula:C12H13ClO3
InChI:InChI=1S/C12H13ClO3/c1-15-8-11(12(14)16-2)10-6-4-3-5-9(10)7-13/h3-6,8H,7H2,1-2H3/b11-8+
InChI key:InChIKey=QHBMFLGCOYKWJH-DHZHZOJOSA-N
SMILES:C(\C(OC)=O)(=C/OC)/C1=C(CCl)C=CC=C1
Synonyms:
  • Benzeneacetic acid, 2-(chloromethyl)-α-(methoxymethylene)-, methyl ester, (αE)-
  • Benzeneacetic acid, 2-(chloromethyl)-α-(methoxymethylene)-, methyl ester, (E)-
  • Methyl (E)-3-methoxy-2-(2-chloromethylphenyl)-2-propenoate
  • Methyl (αE)-2-(chloromethyl)-α-(methoxymethylene)benzeneacetate
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