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CS-W001157 4
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1-(3,5-Dichloro-2-fluorophenyl)ethanone

  • CAS No. 480438-93-5

  • Cat. No. CS-0037694
  • Molecule weight207.03
  • Purity≥96%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

1-(3,5-Dichloro-2-fluorophenyl)ethanone|CS-0037694

Structure of 480438-93-5

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General Information

  • CAS No. 480438-93-5
  • Cat. No. CS-0037694
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅Cl₂FO
  • Molecular Weight 207.03
  • Synonym(s) 3,5-Dichloro-2-fluoroacetophenone
  • SMILES CC(=O)C1=C(C(=CC(=C1)Cl)Cl)F

Description

1-(3,5-Dichloro-2-fluorophenyl)ethanone features a trifunctional aryl core with orthogonal reactivity, enabling seamless integration into diverse synthetic architectures. The electron-deficient ring facilitates electrophilic substitution, while the acetyl group provides a robust handle for derivatization under standard conditions. This compound demonstrates excellent bench stability and compatibility with common organic solvents.

Application

1-(3,5-Dichloro-2-fluorophenyl)ethanone serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles and pharmaceutical scaffolds. Its trifluoromethyl-like electronic profile and orthogonal reactivity facilitate efficient functionalization in late-stage synthesis. The molecule exhibits excellent bench stability, tolerates a range of reaction conditions, and simplifies purification due to its well-defined crystalline nature, making it ideal for scalable process development and high-throughput screening workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
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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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.3351
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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