Enantiomeric Excess Calculator:
Enter the values of major enantiomer amount, Me(%) and minor enantiomer amount, me(%) to determine the value of Enantiomeric Excess, EE(%).
Enantiomeric Excess:
Enantiomeric excess (EE) quantifies the purity of a chiral compound based on its optical activity, reflecting the ratio of one enantiomer to the other.It represents the percentage difference between the amounts of two enantiomers present in a mixture.
Enantiomeric excess occurs when one enantiomer is present in a higher proportion than the other in a mixture. In contrast, if the enantiomers are present in equal amounts, the enantiomeric excess is 0%, signifying a racemic mixture.
A 100% enantiomeric excess means only one enantiomer is present and no trace of the other exists.Enantiomeric excess is important in fields like pharmaceuticals, where the activity of a drug may depend strongly on its chirality.Higher EE values indicate higher stereoselectivity and purer enantiomeric compositions.It is crucial in synthesizing compounds where the desired biological effect comes from a single enantiomer.
The measurement of EE helps to quantify how selective a chemical reaction is in producing one enantiomer over the other.Enantiomeric excess can be determined by techniques such as polarimetry, chromatography, or NMR analysis.
The calculation requires the percentage or moles of each enantiomer present in the sample.A positive EE value indicates excess of the major enantiomer, while a negative value would suggest the minor is more abundant (though normally expressed positively).Maintaining a high EE is critical in industrial applications to meet regulatory and therapeutic standards.
The formula for EE uses either percentages or mole amounts, focusing on the difference between the major (Me) and minor (me) enantiomers.Regular monitoring and control during production ensure that the enantiomeric purity (EE) remains within acceptable limits.
Enantiomeric Excess, EE(%) in percentage equals the major enantiomer amount, Me(%) in percentage minus the minor enantiomer amount, me(%) in percentage.
Enantiomeric Excess, EE(%) = Me(%) – me(%)
EE(%) = enantiometric excess in percentage.
Me(%) = major enantiometric amount in percentage.
me(%) = minor enantiometric amount in percentage.
Enantiomeric Excess Calculation:
- A sample contains 70% of the R-enantiomer and 30% of the S-enantiomer. Find the enantiomeric excess (EE).
Given: Me(%) = 70%, me(%) = 30%.
Enantiomeric Excess, EE(%) = Me(%) – me(%)
EE(%) = 70 – 30
EE(%) = 40%.
- A mixture has a major enantiomer amount (Me) of 90% and an enantiomeric excess (EE) of 80%. Find the amount of the minor enantiomer (me).
Given: Me(%) = 90%, EE(%) = 80%.
Enantiomeric Excess, EE(%) = Me(%) – me(%)
me(%) = Me(%) – EE(%)
me(%) = 90 – 80
me(%) = 10%.