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Structure of 86776-52-5
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4-Cyano-3-fluorophenyl 4-butylbenzoate features a fluorinated aromatic ring paired with a nitrile group, enabling enhanced electron-withdrawing character and improved metabolic stability. The extended butyl chain imparts favorable solubility in organic media and reduces crystallinity, streamlining handling in synthetic workflows. This structure integrates seamlessly into complex molecular architectures requiring balanced lipophilicity and reactivity.
4-Cyano-3-fluorophenyl 4-butylbenzoate serves as a versatile building block in medicinal chemistry, enabling the synthesis of biologically active heterocycles and functionalized aryl scaffolds. Its dual electron-withdrawing groups (cyano and fluorine) enhance reactivity in nucleophilic aromatic substitution, while the ester functionality supports downstream transformations. The butyl chain provides favorable solubility and metabolic stability, making it suitable for lead optimization campaigns.
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GHS Pictogram :
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GHS No : GHS07
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Signal Word : Warning
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UN#: N/A
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Class : N/A
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Packing Group : N/A
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Hazard Statements : H302-H315-H319-H335
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Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Lot numbers can be found on the outside label of a product: