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CAS 121629-14-9

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Methyl 4,4-difluorocyclohexanecarboxylate

Description:
Methyl 4,4-difluorocyclohexanecarboxylate is an organic compound characterized by its cyclohexane ring structure, which is substituted with two fluorine atoms at the 4-position and a carboxylate functional group. This compound is typically a colorless to pale yellow liquid with a distinctive odor. It is soluble in organic solvents and exhibits moderate stability under standard conditions. The presence of fluorine atoms contributes to its unique chemical properties, such as increased lipophilicity and potential bioactivity. Methyl 4,4-difluorocyclohexanecarboxylate may be utilized in various applications, including pharmaceuticals and agrochemicals, due to its potential as an intermediate in synthetic pathways. Safety data indicates that, like many fluorinated compounds, it should be handled with care, as it may pose environmental and health risks. Proper storage and disposal methods are essential to mitigate any hazards associated with its use.
Formula:C8H12F2O2
InChI:InChI=1S/C8H12F2O2/c1-12-7(11)6-2-4-8(9,10)5-3-6/h6H,2-5H2,1H3
InChI key:InChIKey=XHYGYNWRARNCHL-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1CCC(F)(F)CC1
Synonyms:
  • 4,4-Difluoro-cyclohexanecarboxylic acid methyl ester
  • Methyl 4,4-difluorocyclohexanecarboxylate
  • Cyclohexanecarboxylic acid, 4,4-difluoro-, methyl ester
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