{"compilation": {"title": "Solubility data from IUPAC SDS Volume 38 (page ?) - Pyrene with Water", "publisher": "The International Union of Pure and Applied Chemistry", "keywords": "Solubility, Solubility data series", "compilers": "Andrzej Maczynski", "sources": [{"citation": "May, W. E.; Wasik, S. P.; Freeman, D. H.; Anal. Chem. 1978, 50, 997-1000", "pubtype": "paper", "url": "https://doi.org/10.1021/ac50029a042"}], "system": "Pyrene with Water", "substances": [{"constituent": 1, "name": "Pyrene", "formula": "C16H10", "molweight": 202.251, "casrn": "129-00-0", "inchi": "InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H", "inchikey": "BBEAQIROQSPTKN-UHFFFAOYSA-N", "sample": "Commercial product; less than 3% impurities."}, {"constituent": 2, "name": "Water", "formula": "H2O", "molweight": 18.0153, "casrn": "7732-18-5", "inchi": "InChI=1S/H2O/h1H2", "inchikey": "XLYOFNOQVPJJNP-UHFFFAOYSA-N", "sample": "Distilled over $\\ce{KMnO4}$ and $\\ce{NaOH}$ and passed through a column packed with XAD-2 (Rohm and Hass, Philadelphia, Pa.)"}], "method": "The dynamic coupled column liquid chromatography (DCCLC) method was based on generating saturated solutions by pumping water through a column packed with glass beads that have been coated with the component [1] (generator column). The concentration of [1] in the effluent of the generator column was measured by a modification of the coupled column liquid chromatographic process that has been described in [1].", "reference": {"citation": "May, W.; Chesler, S.; Cram, S.; Gump, B.; Hertz, H.; Enagonio, D.; Dyszel, S.; J. Chromatogr. Sci. 1975, 13, 535.", "pubtype": "paper", "url": "https://doi.org/10.1093/chromsci/13.11.535"}, "dataset": [{"series": 1, "title": "Solubility of pyrene in water", "points": [{"pntnum": 1, "conditions": [{"property": "Ambient temperature", "number": "2.5e+01", "significand": "2.5", "exponent": "1", "sigfigs": "2", "unit": "&deg;C"}], "data": [{"property": "Relative mass (1 in 2)", "number": "1.32e-01", "significand": "1.32", "exponent": "-1", "sigfigs": "3", "unit": "mg/kg"}], "supplemental": [{"property": "Mole fraction - Liquid (1)", "number": "1.18e-08", "significand": "1.18", "exponent": "-8", "sigfigs": "3", "unit": "1"}, {"property": "Relative mass - solution (1)", "number": "1.32e-05", "significand": "1.32", "exponent": "-5", "sigfigs": "3", "unit": "g<sub>1</sub>/100 g sln"}]}, {"pntnum": 2, "conditions": [{"property": "Ambient temperature", "number": "2.9e+01", "significand": "2.9", "exponent": "1", "sigfigs": "2", "unit": "&deg;C"}], "data": [{"property": "Relative mass (1 in 2)", "number": "1.62e-01", "significand": "1.62", "exponent": "-1", "sigfigs": "3", "unit": "mg/kg"}], "supplemental": [{"property": "Mole fraction - Liquid (1)", "number": "1.44e-08", "significand": "1.44", "exponent": "-8", "sigfigs": "3", "unit": "1"}, {"property": "Relative mass - solution (1)", "number": "1.62e-05", "significand": "1.62", "exponent": "-5", "sigfigs": "3", "unit": "g<sub>1</sub>/100 g sln"}]}]}]}}