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CS-W001157 4
Total: USD 88.00

3,4-Difluoro-N-methylaniline

  • CAS No. 138563-54-9

  • Cat. No. CS-0151035
  • Purity≥98%
  • MDL No.MFCD11152726

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

3,4-Difluoro-N-methylaniline|CS-0151035

Structure of 138563-54-9

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General Information

  • CAS No. 138563-54-9
  • Cat. No. CS-0151035
  • Purity ≥98%
  • MDL No. MFCD11152726
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇F₂N
  • Molecular Weight 143.13
  • Synonym(s) (3,4-difluoro-phenyl)-methyl-amine
  • SMILES CNC1=CC(=C(C=C1)F)F

Description

3,4-Difluoro-N-methylaniline features a fluorinated aromatic ring paired with a methylaniline side chain, delivering enhanced electron density and improved metabolic stability. This combination enables efficient incorporation into bioactive scaffolds and facilitates selective coupling reactions under mild conditions.

Application

3,4-Difluoro-N-methylaniline serves as a valuable building block in medicinal chemistry, enabling the construction of fluorinated aromatic scaffolds through standard coupling reactions. Its ortho-fluorine substituents enhance metabolic stability and modulate electronic properties, while the N-methyl group improves lipophilicity and membrane permeability. The compound exhibits good bench stability and is compatible with common reaction conditions, facilitating straightforward purification and integration into complex molecular architectures.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS06
Signal Word : Danger
UN#: 2922
Class : 8 (6.1)
Packing Group : Ⅲ
Hazard Statements : H227-H301-H315-H317-H318-H335-H412
Precautionary Statements : P210-P235-P261-P264-P270-P271-P272-P280-P302+P352-P304+P340-P330-P362-P370+P378-P405-P501

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Computational Chemistry Data

  • TPSA   12.03
  • LogP   2.0065
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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