{"compilation": {"title": "Solubility data from IUPAC SDS Volume 77 (page ?) - Nitroethane with Heptacosafluorotributanamine", "publisher": "The International Union of Pure and Applied Chemistry", "keywords": "Solubility, Solubility data series", "compilers": "Valerii P. Sazonov, Nikolai I. Lisov", "sources": [{"citation": "Vreeland, J.; Dunlap, R.; J. Phys. Chem. 61, 329-33 (1957).", "pubtype": "paper", "url": "https://doi.org/10.1021/j150549a012"}], "system": "Nitroethane with Heptacosafluorotributanamine", "substances": [{"constituent": 1, "name": "Nitroethane", "formula": "C2H5NO2", "molweight": 75.0666, "casrn": "79-24-3", "inchi": "InChI=1S/C2H5NO2/c1-2-3(4)5/h2H2,1H3", "inchikey": "MCSAJNNLRCFZED-UHFFFAOYSA-N", "sample": "Matheson Chemical Co.; research grade; distilled through a Todd column; b. p. = 114.7°C - 114.8°C."}, {"constituent": 2, "name": "Heptacosafluorotributanamine", "formula": "C12F27N", "molweight": 671.092, "casrn": "311-89-7", "inchi": "InChI=1S/C12F27N/c13-1(14,7(25,26)27)4(19,20)10(34,35)40(11(36,37)5(21,22)2(15,16)8(28,29)30)12(38,39)6(23,24)3(17,18)9(31,32)33", "inchikey": "RVZRBWKZFJCCIB-UHFFFAOYSA-N", "sample": "Minnesota Mining and Manufacturing Co.; distilled; b. p. = 178.8°C - 179.1°C."}], "method": "No experimental details given.", "dataset": []}}