(1E)-2,2,2-trifluoro-1-[(1S,4R)-4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanylidene]ethanolate (1E)-2,2,2-tris(fluoranyl)-1-[(1S,4R)-4,7,7-trimethyl-3-oxidanylidene-2-bicyclo[2.2.1]heptanylidene]ethanolate 51800-98-7 A828784 CAS 51800-98-7

Purity 97%+In StockPharmaceutical Standards
CAS No.51800-98-7
Molecular FormulaC12H15F3O2
Molecular Weight248.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

(1E)-2,2,2-trifluoro-1-[(1S,4R)-4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanylidene]ethanolate
(1E)-2,2,2-tris(fluoranyl)-1-[(1S,4R)-4,7,7-trimethyl-3-oxidanylidene-2-bicyclo[2.2.1]heptanylidene]ethanolate
51800-98-7
A828784 CAS 51800-98-7 chemical structure

Description

The occurrence of (1E)-2,2,2-trifluoro-1-[(1S,4R)-4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanylidene]ethanolate (1E)-2,2,2-tris(fluoranyl)-1-[(1S,4R)-4,7,7-trimethyl-3-oxidanylidene-2-bicyclo[2.2.1]heptanylidene]ethanolate 51800-98-7 A828784 is closely related to a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies (1E)-2,2,2-trifluoro-1-[(1S,4R)-4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanylidene]ethanolate (1E)-2,2,2-tris(fluoranyl)-1-[(1S,4R)-4,7,7-trimethyl-3-oxidanylidene-2-bicyclo[2.2.1]heptanylidene]ethanolate 51800-98-7 A828784 (CAS 51800-98-7), a certified reference material (molecular formula C12H15F3O2, MW 248.24 g/mol) for analytical method development and quality control.

Based on its molecular formula C12H15F3O2, (1E)-2,2,2-trifluoro-1-[(1S,4R)-4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanylidene]ethanolate (1E)-2,2,2-tris(fluoranyl)-1-[(1S,4R)-4,7,7-trimethyl-3-oxidanylidene-2-bicyclo[2.2.1]heptanylidene]ethanolate 51800-98-7 A828784 contains a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 248.24 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

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 FormulaC12H15F3O2
Molecular Weight248.24 g/mol
AppearanceOff-white to pale yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at room temperature, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Contains ester bond; hydrolyzes under strong alkaline conditions
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1971
Halogen ContentF-containing

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