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- W2051210752 abstract "A convenient procedure has been developed for the determination of partition and distribution coefficients. The method involves the potentiometric titration of the compound, first in water and then in a rapidly stirred mixture of water and octanol. An automatic titrator is used, and the data is collected and analyzed by curve fitting on a microcomputer with 64 K of memory. The method is rapid and accurate for compounds with pKa values between 4 and 10. Partition coefficients can be measured for monoprotic and diprotic acids and bases. The partition coefficients of the neutral compound and its ion(s) can be determined by varying the ratio of octanol to water. Distribution coefficients calculated over a wide range of pH values are presented graphically as distribution profiles. It is shown that subtraction of the titration curve of solvent alone from that of the compound in the solvent offers advantages for pKa determination by curve fitting for compounds of low aqueous solubility." @default.
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- W2051210752 date "1987-08-01" @default.
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- W2051210752 title "Ionization Constants by Curve Fitting: Determination of Partition and Distribution Coefficients of Acids and Bases and Their Ions" @default.
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- W2051210752 doi "https://doi.org/10.1002/jps.2600760806" @default.
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