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CS-W001157 4
Total: USD 88.00

4-Bromo-2-fluoro-6-nitroaniline

  • CAS No. 517920-70-6

  • Cat. No. CS-W005040
  • Purity≥96%
  • MDL No.MFCD03094271

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

4-Bromo-2-fluoro-6-nitroaniline|CS-W005040

Structure of 517920-70-6

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General Information

  • CAS No. 517920-70-6
  • Cat. No. CS-W005040
  • Purity ≥96%
  • MDL No. MFCD03094271
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄BrFN₂O₂
  • Molecular Weight 235.01
  • Synonym(s) 4-Bromo-2-fluoro-6-nitro-phenylamine
  • SMILES BrC1=CC(F)=C(N)C([N+]([O-])=O)=C1

Description

Widely used for protection of amino groups in peptide synthesis and multi-step organic synthesis of small molecules.

Application

4-Bromo-2-fluoro-6-nitroaniline serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling direct substitution reactions at the bromine position via palladium-catalyzed cross-coupling. The ortho-fluoro and meta-nitro groups provide strong electron-withdrawing effects, enhancing reactivity in nucleophilic aromatic substitution. Its bench-stable crystalline form facilitates handling and purification, while compatibility with diverse functional groups supports downstream derivatization 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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P301+P310-P302+P352-P304+P341-P312-P330-P363-P501

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Computational Chemistry Data

  • TPSA   69.16
  • LogP   2.0786
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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