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CS-W001157 4
Total: USD 88.00

3-Chloro-4-(trifluoromethyl)benzaldehyde

  • CAS No. 83279-38-3

  • Cat. No. CS-W005004
  • Purity≥98%
  • MDL No.MFCD03095197

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

3-Chloro-4-(trifluoromethyl)benzaldehyde|CS-W005004

Structure of 83279-38-3

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General Information

  • CAS No. 83279-38-3
  • Cat. No. CS-W005004
  • Purity ≥98%
  • MDL No. MFCD03095197
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₄ClF₃O
  • Molecular Weight 208.57
  • Synonym(s) 3-chloro-4-trifluoromethoxybenaldehyde
  • SMILES O=CC1=CC=C(C(F)(F)F)C(Cl)=C1

Description

3-Chloro-4-(trifluoromethyl)benzaldehyde features a trifluoromethyl group that enhances electron-withdrawal and metabolic stability, while the chloro substituent provides a site for further functionalization. This aromatic aldehyde integrates readily into pharmaceutical intermediates and agrochemical scaffolds under standard conditions.

Application

3-Chloro-4-(trifluoromethyl)benzaldehyde serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient construction of biologically active heterocycles. Its electron-deficient aromatic core facilitates nucleophilic substitution and coupling reactions, while the aldehyde group permits straightforward derivatization via condensation, reductive amination, or cyanide addition. Bench-stable and compatible with standard purification methods, it functions reliably in multi-step syntheses requiring robust functional group tolerance.

Synthesis

  • Route1

    References

    • ABBOTT LABORATORIES Patent: US2009/124666 A1, 2009 ; Location in patent: Page/Page column 30-32 ;

Safety Information

Download SDS
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-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   17.07
  • LogP   3.1713
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   1

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