{"compilation": {"title": "Solubility data from IUPAC SDS Volume 37 (page 437) - 1,3,5-Cycloheptatriene with Water", "publisher": "The International Union of Pure and Applied Chemistry", "keywords": "Solubility, Solubility data series", "compilers": "Marie C. Haulait-Pirson", "sources": [{"citation": "Pierotti, R. A.; Liabastre, A. A.; \"Structure and properties of water solutions. \" U. S. Nat. Tech. Inform. Serv.; PB Rep.; 1972, No. 21163, 113 p.", "pubtype": "report"}], "system": "1,3,5-Cycloheptatriene with Water", "substances": [{"constituent": 2, "name": "Water", "formula": "H2O", "molweight": 18.0153, "casrn": "7732-18-5", "inchi": "InChI=1S/H2O/h1H2", "inchikey": "XLYOFNOQVPJJNP-UHFFFAOYSA-N", "sample": "laboratory distilled water."}, {"constituent": 1, "name": "1,3,5-Cycloheptatriene", "formula": "C7H8", "molweight": 92.1384, "casrn": "544-25-2", "inchi": "InChI=1S/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H2", "inchikey": "CHVJITGCYZJHLR-UHFFFAOYSA-N", "sample": "Columbia Organic Chemicals Co., Inc.; Tech 83%; used as received."}], "method": "10 mL of (2) were placed along with 4-10 drops of (1) in 10 mL serum bottles, which were then tightly capped, and placed in the rotating basket and rotated for 24 hours. The bottled were then hand shaken to remove (1) droplets from the stoppers and then replaced in the bath with the tops down for an additional 24 hours. The solute concentrations were determined by use of a flame-ionization gas chromatograph. Many details about equipment, operating conditions and calculation are given in the paper.", "dataset": [{"series": 1, "title": "Solubility of 1,3,5-cycloheptatriene in water", "points": [{"pntnum": 1, "conditions": [{"property": "Ambient temperature", "number": "2.7826e+02", "significand": "2.7826", "exponent": "2", "sigfigs": "5", "unit": "$\\pu{K}$"}], "data": [{"property": "Mole fraction - Liquid (1)", "number": "1.136e-04", "significand": "1.136", "exponent": "-4", "sigfigs": "4", "unit": "1"}, {"property": "Relative mass - solution (1)", "number": "5.809e-02", "significand": "5.809", "exponent": "-2", "sigfigs": "4", "unit": "g<sub>1</sub>/100 g<sub>2</sub>"}], "supplemental": []}, {"pntnum": 2, "conditions": [{"property": "Ambient temperature", "number": "2.8836e+02", "significand": "2.8836", "exponent": "2", "sigfigs": "5", "unit": "$\\pu{K}$"}], "data": [{"property": "Mole fraction - Liquid (1)", "number": "1.299e-04", "significand": "1.299", "exponent": "-4", "sigfigs": "4", "unit": "1"}, {"property": "Relative mass - solution (1)", "number": "6.645e-02", "significand": "6.645", "exponent": "-2", "sigfigs": "4", "unit": "g<sub>1</sub>/100 g<sub>2</sub>"}], "supplemental": []}, {"pntnum": 3, "conditions": [{"property": "Ambient temperature", "number": "2.9826e+02", "significand": "2.9826", "exponent": "2", "sigfigs": "5", "unit": "$\\pu{K}$"}], "data": [{"property": "Mole fraction - Liquid (1)", "number": "1.309e-04", "significand": "1.309", "exponent": "-4", "sigfigs": "4", "unit": "1"}, {"property": "Relative mass - solution (1)", "number": "6.694e-02", "significand": "6.694", "exponent": "-2", "sigfigs": "4", "unit": "g<sub>1</sub>/100 g<sub>2</sub>"}], "supplemental": []}, {"pntnum": 4, "conditions": [{"property": "Ambient temperature", "number": "3.0836e+02", "significand": "3.0836", "exponent": "2", "sigfigs": "5", "unit": "$\\pu{K}$"}], "data": [{"property": "Mole fraction - Liquid (1)", "number": "1.450e-04", "significand": "1.450", "exponent": "-4", "sigfigs": "4", "unit": "1"}, {"property": "Relative mass - solution (1)", "number": "7.418e-02", "significand": "7.418", "exponent": "-2", "sigfigs": "4", "unit": "g<sub>1</sub>/100 g<sub>2</sub>"}], "supplemental": []}, {"pntnum": 5, "conditions": [{"property": "Ambient temperature", "number": "3.1836e+02", "significand": "3.1836", "exponent": "2", "sigfigs": "5", "unit": "$\\pu{K}$"}], "data": [{"property": "Mole fraction - Liquid (1)", "number": "1.495e-04", "significand": "1.495", "exponent": "-4", "sigfigs": "4", "unit": "1"}, {"property": "Relative mass - solution (1)", "number": "7.648e-02", "significand": "7.648", "exponent": "-2", "sigfigs": "4", "unit": "g<sub>1</sub>/100 g<sub>2</sub>"}], "supplemental": []}]}]}}