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CS-W001157 4
Total: USD 88.00

(R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoic acid

  • CAS No. 44864-47-3

  • Cat. No. CS-W000653
  • Molecule weight158.08
  • Purity≥95%
  • MDL No.MFCD03095400

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

(R)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoic acid|CS-W000653

Structure of 44864-47-3

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General Information

  • CAS No. 44864-47-3
  • Cat. No. CS-W000653
  • Purity ≥95%
  • MDL No. MFCD03095400
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₄H₅F₃O₃
  • Molecular Weight 158.08
  • Synonym(s) Propanoic acid, 3,3,3-trifluoro-2-hydroxy-2-methyl-, (2R)-
  • SMILES OC(=O)[C@](C(F)(F)F)(O)C

Description

(R)-3,3,3-Trifluoro-2-hydroxy-2-methylpropanoic acid features a chiral center flanked by a trifluoromethyl group and a hydroxyl-bearing methyl moiety, delivering enhanced steric and electronic properties. This bench-stable compound integrates readily into asymmetric synthesis workflows, where its polar functionality enables selective transformations under mild conditions.

Application

(R)-3,3,3-Trifluoro-2-hydroxy-2-methylpropanoic acid serves as a valuable chiral building block for fluorinated bioactive molecules, enabling direct incorporation of a trifluoromethyl group adjacent to a stereogenic center. Its hydroxyl and carboxylic acid functionalities provide orthogonal handles for derivatization, while the geminal trifluoromethyl motif imparts enhanced metabolic stability and lipophilicity. The compound exhibits bench stability and facilitates efficient purification, making it well-suited for medicinal chemistry campaigns targeting CNS agents and kinase inhibitors.

Safety Information

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GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 3261
Class : 8
Packing Group : Ⅲ
Hazard Statements : H290-H314
Precautionary Statements : P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P363-P405-P501

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Computational Chemistry Data

  • TPSA   57.53
  • LogP   0.3843
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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