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CS-W001157 4
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2-Fluoro-3-methylbenzonitrile

  • CAS No. 185147-07-3

  • Cat. No. CS-W003435
  • Molecule weight135.14
  • Purity≥98%
  • MDL No.MFCD07782078

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

2-Fluoro-3-methylbenzonitrile|CS-W003435

Structure of 185147-07-3

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General Information

  • CAS No. 185147-07-3
  • Cat. No. CS-W003435
  • Purity ≥98%
  • MDL No. MFCD07782078
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆FN
  • Molecular Weight 135.14
  • Synonym(s) 2-Fluor-3-methylbenzolcarbonitril
  • SMILES N#CC1=CC=CC(C)=C1F

Description

2-Fluoro-3-methylbenzonitrile features a fluorinated aromatic ring with adjacent methyl and nitrile groups, offering enhanced electron-withdrawing character and improved metabolic stability. This configuration enables efficient incorporation into pharmaceutical intermediates and advanced materials, particularly in the synthesis of kinase inhibitors and functionalized polymers under standard reaction conditions.

Application

2-Fluoro-3-methylbenzonitrile serves as a versatile building block in medicinal chemistry, enabling direct functionalization at the electron-deficient aromatic ring. Its fluorine and nitrile groups offer orthogonal reactivity for late-stage derivatization, while the methyl substituent provides a handle for oxidation or cross-coupling. Bench-stable and compatible with standard coupling protocols, it facilitates efficient access to substituted benzimidazoles, pyridines, and other heterocyclic scaffolds relevant to API development.

Safety Information

Download SDS
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   23.79
  • LogP   2.0058
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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