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CS-W001157 4
Total: USD 88.00

4-Fluorobenzothioamide

  • CAS No. 22179-72-2

  • Cat. No. CS-0187014
  • Purity≥98%
  • MDL No.None

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

4-Fluorobenzothioamide|CS-0187014

Structure of 22179-72-2

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General Information

  • CAS No. 22179-72-2
  • Cat. No. CS-0187014
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₆FNS
  • Molecular Weight 155.19
  • Synonym(s) 4-Fluorothiobenzamide
  • SMILES C1=C(C=CC(=C1)F)C(=S)N

Description

4-Fluorobenzothioamide features a fluorinated aromatic ring paired with a thioamide functional group, delivering enhanced electronic effects and metabolic stability. This combination enables direct incorporation into heterocyclic scaffolds and facilitates conjugation in medicinal chemistry workflows. The compound exhibits good solubility in common organic solvents and maintains stability under standard bench conditions.

Application

4-Fluorobenzothioamide serves as a versatile building block in medicinal chemistry, enabling the construction of heterocyclic scaffolds through cyclization reactions. Its fluorinated aryl moiety enhances metabolic stability and modulates electronic properties, while the thioamide group provides reliable reactivity in amide bond formation and transition metal-catalyzed coupling processes. Bench-stable and readily purified by recrystallization, it functions effectively in multi-step syntheses requiring functional group tolerance and predictable reactivity.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.4599
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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