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CS-W001157 4
Total: USD 88.00

3,5-Difluorobenzylamine

  • CAS No. 90390-27-5

  • Cat. No. CS-W018264
  • Purity≥98%
  • MDL No.MFCD00061244

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

3,5-Difluorobenzylamine|CS-W018264

Structure of 90390-27-5

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General Information

  • CAS No. 90390-27-5
  • Cat. No. CS-W018264
  • Purity ≥98%
  • MDL No. MFCD00061244
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇F₂N
  • Molecular Weight 143.14
  • Synonym(s) Difluorobenzylamine6
  • SMILES NCC1=CC(F)=CC(F)=C1

Application

3,5-Difluorobenzylamine serves as a valuable building block in medicinal chemistry, enabling the construction of fluorinated aromatic scaffolds commonly found in bioactive molecules. Its ortho-difluoro substitution pattern enhances metabolic stability and modulates electronic properties, while the primary amine functionality facilitates straightforward conjugation via amide, urea, or imine formation. The compound exhibits good bench stability and is compatible with standard purification techniques, making it well-suited for iterative synthesis campaigns and lead optimization workflows.

Synthesis

  • Route1

    References

    • Organic Letters, , vol. 1, # 2 p. 183 - 185
  • Route2
    • 3,5-Difluorobenzaldehyde oxime|CS-0524403
      677728-83-5
    • ~%
    • In-stock
      3,5-Difluorobenzylamine|CS-W018264
      90390-27-5

    References

    • Journal of Medicinal Chemistry, , vol. 27, # 9 p. 1111 - 1118

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅲ
Hazard Statements : H227-H314
Precautionary Statements : P210-P260-P264-P280-P301+P330+P331-P304+P340-P363-P370+P378-P403-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.4235
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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