{"compilation": {"title": "Solubility data from IUPAC SDS Volume 20 (page 10) - Pentachlorophenol with Water", "publisher": "The International Union of Pure and Applied Chemistry", "keywords": "Solubility, Solubility data series", "compilers": "A. Vesala", "sources": [{"citation": "Blackman, G. E.; Park, M. H.; Garton, G.; Arch. Biochem. Biophys. 1955, 54(1), 55-71.", "pubtype": "paper", "url": "https://doi.org/10.1016/0003-9861(55)90008-4"}], "system": "Pentachlorophenol with Water", "substances": [{"constituent": 1, "name": "Pentachlorophenol", "formula": "C6HCl5O", "molweight": 266.337, "casrn": "87-86-5", "inchi": "InChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H", "inchikey": "IZUPBVBPLAPZRR-UHFFFAOYSA-N", "sample": "Probably a commercial reagent."}, {"constituent": 2, "name": "Water", "formula": "H2O", "molweight": 18.0153, "casrn": "7732-18-5", "inchi": "InChI=1S/H2O/h1H2", "inchikey": "XLYOFNOQVPJJNP-UHFFFAOYSA-N", "sample": "Distilled water."}], "method": "The samples were equilibrated in a thermostat bath with intermittent shaking over periods of 3-4 weeks. During the equilibration time, the pH values of the solutions were controlled by dropwise addition of phosphate buffer solution. The analysis of the solute concentration in the saturated samples was done spectrophotometrically either directly or by using proper colorizing agents.", "dataset": [{"series": 1, "points": [{"pntnum": 1, "conditions": [{"property": "Ambient temperature", "number": "2.5e+01", "significand": "2.5", "exponent": "1", "sigfigs": "2", "unit": "&deg;C"}], "data": [{"property": "Amount concentration (1)", "number": "3.6e-05", "significand": "3.6", "exponent": "-5", "sigfigs": "2", "unit": "mol/dm<sup>3</sup>"}], "supplemental": [{"property": "Mole fraction - Liquid (1)", "number": "6.51e-07", "significand": "6.51", "exponent": "-7", "sigfigs": "3", "unit": "1"}, {"property": "Mass concentration (m/v) (1)", "number": "9.59e-03", "significand": "9.59", "exponent": "-3", "sigfigs": "3", "unit": "g(1)/dm<sup>3</sup>"}]}]}]}}