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CAS 86776-51-4

4-Cyano-3-fluorophenyl 4-Propylbenzoate TCI C3554

4-Cyano-3-fluorophenyl 4-Propylbenzoate TCI C3554

Chemical Identity

Other names
4-Propylbenzoic Acid 4-Cyano-3-fluorophenyl Ester
CAS No.
86776-51-4
PubChem
CID 590093·SID 468591156
Formula
C17H14FNO2
Molecular weight
283.30 g/mol
Purity
>98.0%(GC)
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
(4-cyano-3-fluorophenyl) 4-propylbenzoate
SMILES
CCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F
InChIKey
RDPCRVRASQOZBX-UHFFFAOYSA-N
MDL
MDL06797522
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4-Cyano-3-fluorophenyl 4-Propylbenzoate is a chemical compound widely used as a building block in the synthesis of complex molecules. This compound plays a crucial role in organic chemistry laboratories, where it serves as a versatile intermediate for the development of various compounds. Its unique molecular structure, featuring both fluorine and cyanide groups, allows for specific reactivity and functional group compatibility. This makes it an essential tool for researchers aiming to create compounds with tailored properties.

The compound’s reactivity is further enhanced by its ability to participate in substitution and conjugation reactions. Its high reactivity and compatibility with multiple functional groups make it a preferred choice for synthetic chemists. The presence of fluorine atoms also contributes to the compound’s stability under certain reaction conditions, facilitating efficient synthesis processes. Additionally, its solubility in organic solvents simplifies purification and isolation steps in laboratory workflows.

In Indonesian laboratories, this compound is commonly used by researchers in academic institutions and research centers. It is particularly valuable in the development of pharmaceuticals, dyes, and materials with specialized applications. Its role in creating bioactive compounds has made it a key component in drug discovery and chemical innovation efforts. The compound’s versatility and chemical properties make it a reliable choice for a wide range of synthetic applications.

  • Organic synthesis for the creation of bioactive compounds due to its reactivity and functional group compatibility.
  • Pharmaceutical research as a building block for the development of new drug molecules with specific biological activities.
  • Dye and pigment formulation due to its structural versatility and solubility in organic solvents.
  • Material science applications in the development of advanced polymers and functional materials.
  • Chemical research for the exploration of novel reaction pathways and compound modifications.

Brand TCI
CAS number 86776-51-4
Molecular formula —
Purity —
Category Chemistry > Building Blocks > Fluorinated Building Blocks
Pack sizes Available in standard laboratory quantities
Physical form Solid or liquid, depending on formulation
Storage Store in a cool, dry place away from light and moisture

This compound should be stored in a cool, dry environment, away from direct sunlight and sources of heat. It is recommended to use airtight containers made of glass or high-density polyethylene to prevent contamination and maintain chemical integrity. Due to its reactivity, it should be handled in a well-ventilated laboratory setting, preferably with appropriate personal protective equipment such as gloves and goggles. Avoid contact with incompatible substances and ensure proper waste disposal procedures are followed. Regular monitoring of storage conditions is advised to ensure the compound remains stable and suitable for use in chemical synthesis processes.

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