ChemAxon pKa Calculation:
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The pKa value is a quantitative measure of the strength of an acid in solution. It is the negative base-10 logarithm of the acid dissociation constant (Ka) for water solutions. ChemAxon provides accurate pKa calculations for various chemical compounds in aqueous solutions.
The calculator uses the fundamental pKa equation:
Where:
Explanation: The pKa value indicates the pH at which a chemical species will accept or donate protons. Lower pKa values indicate stronger acids.
Details: pKa values are crucial in pharmaceutical development, chemical synthesis, and biochemical studies as they affect solubility, absorption, and reactivity of compounds.
Tips: Enter the acid dissociation constant (Ka) in mol/L. The temperature field is optional (default is 25°C). All values must be valid (Ka > 0).
Q1: What is the relationship between pKa and pH?
A: The Henderson-Hasselbalch equation relates them: pH = pKa + log([A⁻]/[HA]), where [A⁻] is conjugate base and [HA] is acid concentration.
Q2: What are typical pKa ranges?
A: Strong acids have pKa < 0, weak acids 0-10, and very weak acids >10. Water's pKa is 15.7 at 25°C.
Q3: How does temperature affect pKa?
A: pKa values are temperature-dependent. Most acids become slightly stronger (lower pKa) as temperature increases.
Q4: What's special about ChemAxon's pKa calculations?
A: ChemAxon uses advanced algorithms to predict pKa values based on molecular structure, accounting for electronic and steric effects.
Q5: Can this calculator handle multi-protic acids?
A: This basic version calculates single pKa values. For polyprotic acids, each dissociation has its own pKa value.