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CS-W001157 4
Total: USD 88.00

4-Bromo-3-fluoro-5-methylaniline

  • CAS No. 1356113-07-9

  • Cat. No. CS-0097448
  • Purity≥97%
  • MDL No.None

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

4-Bromo-3-fluoro-5-methylaniline|CS-0097448

Structure of 1356113-07-9

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General Information

  • CAS No. 1356113-07-9
  • Cat. No. CS-0097448
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇BrFN
  • Molecular Weight 204.04
  • Synonym(s) None
  • SMILES NC1=CC(C)=C(C(F)=C1)Br

Description

4-Bromo-3-fluoro-5-methylaniline features a strategically positioned bromo and fluoro substituent flanking a methylated aniline core, enabling selective coupling reactions in pharmaceutical synthesis. This electron-deficient aromatic amine integrates readily into complex scaffolds under standard conditions, offering enhanced reactivity and stability for advanced intermediate construction.

Application

4-Bromo-3-fluoro-5-methylaniline serves as a valuable building block in the synthesis of pharmaceutical intermediates and functionalized heterocycles. Its ortho-substituted arylamine framework enables reliable coupling reactions, while the bromo and fluoro groups provide orthogonal handles for further derivatization via palladium-catalyzed cross-coupling or nucleophilic substitution. The methyl group enhances metabolic stability and modulates electronic properties, offering predictable reactivity in multi-step syntheses.

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   26.02
  • LogP   2.47882
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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