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CS-W001157 4
Total: USD 88.00

3-(Difluoromethoxy)-4-fluorobenzaldehyde

  • CAS No. 1214367-20-0

  • Cat. No. CS-0133289
  • Molecule weight190.12
  • Purity≥97%
  • MDL No.MFCD14698501

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

3-(Difluoromethoxy)-4-fluorobenzaldehyde|CS-0133289

Structure of 1214367-20-0

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General Information

  • CAS No. 1214367-20-0
  • Cat. No. CS-0133289
  • Purity ≥97%
  • MDL No. MFCD14698501
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅F₃O₂
  • Molecular Weight 190.12
  • Synonym(s) None
  • SMILES O=CC1=CC=C(F)C(OC(F)F)=C1

Description

This difluoromethoxy-substituted benzaldehyde features a fluorinated aldehyde handle for direct incorporation into bioactive scaffolds. The para-fluoro group enhances metabolic stability, while the difluoromethoxy moiety imparts electron-withdrawing character and improved lipophilicity. Ideal for medicinal chemistry campaigns requiring tunable electronic and physicochemical properties under standard bench conditions.

Application

3-(Difluoromethoxy)-4-fluorobenzaldehyde serves as a valuable building block in medicinal chemistry, enabling the synthesis of fluorinated aromatic scaffolds. Its aldehyde functionality facilitates efficient reductive amination, Grignard additions, and Ugi-type condensations. The difluoromethoxy and fluoro substituents enhance metabolic stability and modulate lipophilicity, offering favorable properties for drug discovery applications. The compound exhibits good bench stability and is readily purified by silica gel chromatography or recrystallization.

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-P280-P302+P352

Quality Control

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.2396
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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