4,4,4-trifluoro-2-(2,2,2-trifluoroethyl)butanoic acid CAS 1260806-92-5

Purity 97%+In StockPharmaceutical Standards
CAS No.1260806-92-5
Molecular FormulaC6H6F6O2
Molecular Weight224.10 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4,4,4-trifluoro-2-(2,2,2-trifluoroethyl)butanoic acid CAS 1260806-92-5 chemical structure

Description

Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including 4,4,4-trifluoro-2-(2,2,2-trifluoroethyl)butanoic acid.

4,4,4-trifluoro-2-(2,2,2-trifluoroethyl)butanoic acid (CAS 1260806-92-5) is a high-purity analytical reference standard with the molecular formula C6H6F6O2 and a molecular weight of 224.10 g/mol.

Structurally, 4,4,4-trifluoro-2-(2,2,2-trifluoroethyl)butanoic acid (C6H6F6O2) contains a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 1.0, corresponding to approximately 1 ring(s) or double-bond equivalent(s). With a molecular weight of 224.10 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC6H6F6O2
Molecular Weight224.10 g/mol
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityContains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)1.0
CAS Registry Year (est.)1990
Halogen ContentF-containing

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