1,1,1-TRifluoro-4-(2-phenyl-1h-indol-3-yl)but-3-en-2-one CAS 202074-32-6

Purity 97%+In StockPharmaceutical Standards
CAS No.202074-32-6
Molecular FormulaC18H12F3NO
Molecular Weight315.29 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1,1,1-TRifluoro-4-(2-phenyl-1h-indol-3-yl)but-3-en-2-one CAS 202074-32-6 chemical structure

Description

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.

CATO supplies 1,1,1-TRifluoro-4-(2-phenyl-1h-indol-3-yl)but-3-en-2-one (CAS 202074-32-6), a certified reference material (molecular formula C18H12F3NO, MW 315.29 g/mol) for analytical method development and quality control.

Structurally, 1,1,1-TRifluoro-4-(2-phenyl-1h-indol-3-yl)but-3-en-2-one (C18H12F3NO) contains a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 12.0, corresponding to approximately 12 ring(s) or double-bond equivalent(s). With a molecular weight of 315.29 g/mol, it falls into the moderately-high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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 FormulaC18H12F3NO
Molecular Weight315.29 g/mol
AppearancePale yellow to yellow crystalline powder. (slight halide-like odor, low volatility)
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)12.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2014
Halogen ContentF-containing
Nitrogen Atoms1

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