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CS-W001157 4
Total: USD 88.00

2-(Difluoromethoxy)acetic acid

  • CAS No. 1089695-61-3

  • Cat. No. CS-0102315
  • Molecule weight126.06
  • Purity≥95%
  • MDL No.MFCD28118272

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

2-(Difluoromethoxy)acetic acid|CS-0102315

Structure of 1089695-61-3

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General Information

  • CAS No. 1089695-61-3
  • Cat. No. CS-0102315
  • Purity ≥95%
  • MDL No. MFCD28118272
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₃H₄F₂O₃
  • Molecular Weight 126.06
  • Synonym(s) None
  • SMILES O=C(O)COC(F)F

Description

2-(Difluoromethoxy)acetic acid features a difluoromethoxy group attached to a carboxylic acid moiety, delivering enhanced lipophilicity and metabolic stability. This configuration enables robust integration into bioactive molecules, particularly in medicinal chemistry scaffolds requiring improved membrane permeability and resistance to enzymatic degradation.

Application

2-(Difluoromethoxy)acetic acid serves as a valuable building block for fluorinated bioactive molecules, enabling direct incorporation of the difluoromethoxy group into pharmaceutical and agrochemical scaffolds. Its stability under standard synthetic conditions and compatibility with common coupling reactions facilitate efficient derivatization. The carboxylic acid functionality supports straightforward functionalization via esterification, amide formation, or metalation, making it a practical reagent for medicinal chemistry campaigns targeting enhanced metabolic stability and membrane permeability.

Safety Information

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GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H314-H335
Precautionary Statements : P260-P264-P270-P271-P280-P301+P310-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P312-P330-P363-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   46.53
  • LogP   0.3102
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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