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6-Chloro-2-fluoro-3-methylbenzaldehyde

  • CAS No. 286474-59-7

  • Cat. No. CS-0166660
  • Purity≥97%
  • MDL No.None

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

6-Chloro-2-fluoro-3-methylbenzaldehyde|CS-0166660

Structure of 286474-59-7

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General Information

  • CAS No. 286474-59-7
  • Cat. No. CS-0166660
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₆ClFO
  • Molecular Weight 172.58
  • Synonym(s) 6-CHLORO-2-FLUORO-M-TOLUALDEHYDE
  • SMILES O=CC1=C(Cl)C=CC(C)=C1F

Description

6-Chloro-2-fluoro-3-methylbenzaldehyde features a trifunctional aromatic core with strategically positioned halogens and a methyl group, enabling selective functionalization in complex synthesis. This electron-deficient aldehyde integrates readily into pharmaceutical intermediates and advanced materials, offering enhanced reactivity under standard conditions.

Application

6-Chloro-2-fluoro-3-methylbenzaldehyde serves as a versatile building block in medicinal chemistry, enabling the synthesis of fluorinated heterocycles and bioactive scaffolds. Its ortho-halogenated aryl core facilitates palladium-catalyzed cross-coupling reactions, while the aldehyde group supports imine formation and reductive amination. The methyl substituent enhances metabolic stability, and the compound exhibits excellent bench stability and compatibility with standard purification methods.

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362-P405-P501

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   2.60002
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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