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CAS 6493-77-2

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3-Cyclohexene-1-carboxylic acid, methyl ester

Description:
3-Cyclohexene-1-carboxylic acid, methyl ester, is an organic compound characterized by its cyclohexene ring structure, which features a carboxylic acid functional group esterified with a methyl group. This compound typically appears as a colorless to pale yellow liquid and has a distinctive odor. It is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic cyclohexene ring. The presence of the ester functional group contributes to its reactivity, making it susceptible to hydrolysis under acidic or basic conditions. This compound is often utilized in organic synthesis and may serve as an intermediate in the production of various pharmaceuticals and agrochemicals. Its chemical properties include moderate volatility and a relatively low boiling point, which can influence its handling and storage. Safety data indicates that it should be handled with care, as it may cause irritation upon contact with skin or eyes. Proper safety measures, including the use of personal protective equipment, are recommended when working with this substance.
Formula:C8H12O2
InChI:InChI=1S/C8H12O2/c1-10-8(9)7-5-3-2-4-6-7/h2-3,7H,4-6H2,1H3
InChI key:InChIKey=IPUNVLFESXFVFH-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1CCC=CC1
Synonyms:
  • 1-(Methoxycarbonyl)cyclohex-3-ene
  • 1-Carbomethoxy-3-cyclohexene
  • 3-Cyclohexene-1-Carboxylic Acid Methyl Ester
  • 4-(Methoxycarbonyl)cyclohexene
  • Methyl 1,2,3,6-tetrahydrobenzoate
  • Methyl 3-cyclohexene-1-carboxylate
  • Methyl 4-cyclohexenecarboxylate
  • NSC 93912
  • Methyl 3-cyclohexenecarboxylate
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