{"compilation": {"title": "Solubility data from IUPAC SDS Volume 20 (page 34) - 1,2,3-Trichlorobenzene with Water", "publisher": "The International Union of Pure and Applied Chemistry", "keywords": "Solubility, Solubility data series", "compilers": "A. Vesala", "sources": [{"citation": "Yalkowsky, S. H.; Orr, R. J.; Valvani, S. C.; Ind. Eng. Chem. Fundam. 1979, 18(4), 351-3.", "pubtype": "paper", "url": "https://doi.org/10.1021/i160072a011"}], "system": "1,2,3-Trichlorobenzene with Water", "substances": [{"constituent": 1, "name": "1,2,3-Trichlorobenzene", "formula": "C6H3Cl3", "molweight": 181.447, "casrn": "87-61-6", "inchi": "InChI=1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H", "inchikey": "RELMFMZEBKVZJC-UHFFFAOYSA-N", "sample": "Commercial product (Aldrich or Eastman), used as received."}, {"constituent": 2, "name": "Water", "formula": "H2O", "molweight": 18.0153, "casrn": "7732-18-5", "inchi": "InChI=1S/H2O/h1H2", "inchikey": "XLYOFNOQVPJJNP-UHFFFAOYSA-N", "sample": "Source and purity not specified."}], "method": "A small excess of solute in water was agitated for a period of 4-48 hours (the exact time for equilibration was not reported in single cases) and then filtered. The saturated solution was extracted with a small volume of methylene chloride which was then assayed spectrophotometrically. At least two independent determinations were carried out.", "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": "1.7e-04", "significand": "1.7", "exponent": "-4", "sigfigs": "2", "unit": "mol/dm<sup>3</sup>"}], "supplemental": [{"property": "Mole fraction - Liquid (1)", "number": "3.07e-06", "significand": "3.07", "exponent": "-6", "sigfigs": "3", "unit": "1"}, {"property": "Mass concentration (m/v) (1)", "number": "3.08e-02", "significand": "3.08", "exponent": "-2", "sigfigs": "3", "unit": "g(1)/dm<sup>3</sup>"}]}]}]}}