Dataset https://creativecommons.org/licenses/by/4.0/ Free

BigSolDB 2.1: Solubility Values for Organic Compounds in Organic Solvents and Water

Name: BigSolDB 2.1: Solubility Values for Organic Compounds in Organic Solvents and Water
License: https://creativecommons.org/licenses/by/4.0/

112,465 experimentally measured solubility values of 1,525 organic compounds in 218 solvents reported in 1,687 peer-reviewed articles. Temperature range 243-403 K. Includes mole fraction, molar concentration, and LogS values. Companion density dataset with 218 solvent densities at various temperatures.

Version	2.1
Creator	Lev Krasnov

Keywords

solubilityQSARcheminformaticsmachine learningorganic solventsthermodynamics

Citation

BigSolDB 2.0, dataset of solubility values for organic compounds in different solvents