Ethyl 4-iodobenzoate(CAS: 51934-41-9)

CAS Number
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Basic Information
Molecular Formula
C9H9IO2
Molecular Weight
276.07 g/mol
Physical Properties
Boiling Point
283°C(lit.)
Chemical Identifiers
SMILES
CCOC(=O)C1=CC=C(C=C1)I
InChIKey
YCBJOQUNPLTBGG-UHFFFAOYSA-N
Database References
MDL Number
MFCD00017344
Beilstein Registry Number
2208568
FAQ
Ethyl 4-iodobenzoate has a crystalline form with a molecular weight of approximately 326.23 g/mol. It is slightly soluble in water but more soluble in organic solvents like ethanol and acetone. The compound is less reactive compared to other halogenated benzoic acids but can undergo substitution reactions. It has a pKa value of around 4.5, indicating some acidity.
Ethyl 4-iodobenzoate is typically synthesized through the reaction of 4-hydroxybenzoic acid with sodium iodide in the presence of an organic base such as triethylamine. The reaction is conducted in an organic solvent like ethanol or acetonitrile. The yield is generally high, and the reaction is known for its good selectivity towards iodination.
Ethyl 4-iodobenzoate finds applications in the pharmaceutical industry, particularly in the synthesis of certain drugs. It is also used in the polymer industry to produce iodinated polymers with specific properties. Additionally, it has potential uses in the production of sensors and semiconductors where iodine functionalities are required.
When handling Ethyl 4-iodobenzoate (CAS: 51934-41-9), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work must be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up using appropriate methods and materials, and the area should be thoroughly washed. It is crucial to have a safety data sheet (SDS) readily available for reference in case of emergencies.
Safety Notice
Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.
Always follow proper handling procedures
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