Mole Fraction Formula:
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Definition: This calculator determines the mole fraction of the minor enantiomer based on the percent enantiomeric excess (%ee).
Purpose: It helps chemists and researchers quantify the composition of chiral mixtures and determine the purity of enantiomeric samples.
The calculator uses the formula:
Where:
Explanation: The formula calculates the percentage of the minor enantiomer by subtracting half of the %ee from 50% (the racemic mixture value).
Details: Knowing the fraction of minor isomer is crucial in pharmaceutical development, asymmetric synthesis, and quality control of chiral compounds.
Tips: Enter the percent enantiomeric excess (0-100%). The result shows the mole fraction of the minor enantiomer in the mixture.
Q1: What does %ee mean?
A: Percent enantiomeric excess measures the purity of a chiral sample, representing how much one enantiomer exceeds the other.
Q2: What value should I expect for a racemic mixture?
A: For a racemic mixture (%ee = 0), the calculator will return 50%, indicating equal amounts of both enantiomers.
Q3: What value indicates a pure enantiomer?
A: For a pure enantiomer (%ee = 100), the calculator will return 0%, indicating no presence of the minor enantiomer.
Q4: Can I use this for diastereomers?
A: No, this calculator is specifically for enantiomeric mixtures. Diastereomers require different calculations.
Q5: How is %ee experimentally determined?
A: %ee is typically measured using chiral HPLC, polarimetry, or NMR spectroscopy with chiral shift reagents.