{"@context": ["https://stuchalk.github.io/scidata/contexts/crg_chemical.jsonld", "https://stuchalk.github.io/scidata/contexts/crg_mixture.jsonld", "https://stuchalk.github.io/scidata/contexts/crg_substance.jsonld", "https://stuchalk.github.io/scidata/contexts/scidata.jsonld", "https://stuchalk.github.io/scidata/contexts/sol.jsonld", {"sdo": "https://stuchalk.github.io/scidata/ontology/scidata.owl#", "w3i": "https://w3id.org/skgo/modsci#", "dc": "http://purl.org/dc/terms/", "qudt": "https://qudt.org/vocab/unit/", "xsd": "http://www.w3.org/2001/XMLSchema#", "gb": "https://goldbook.iupac.org/", "so": "https://stuchalk.github.io/scidata/ontology/solubility.owl#", "ss": "http://semanticscience.org/resource/", "obo": "http://purl.obolibrary.org/obo/", "afrl": "http://purl.allotrope.org/ontologies/role#", "afq": "http://purl.allotrope.org/ontologies/quality#", "enm": "http://purl.enanomapper.org/onto/"}, {"@base": "https://srdata.unf.edu/solubility/api/compilation/284/jsonld#"}], "@id": "", "generatedAt": "08-20-26 13:59:58", "version": "1", "@graph": {"@id": "https://srdata.unf.edu/solubility/api/compilation/284/jsonld#", "@type": "sdo:scidataFramework", "uid": "37_156", "title": "Solubility data from IUPAC SDS Volume 37 (page 196) - 1,4-Cyclohexadiene with Water", "authors": [{"@id": "author/1/", "@type": "dc:creator", "name": "Marie C. Haulait-Pirson", "role": "compiler"}], "description": "Compiled solubility data reported in the IUPAC Solubility Data Series", "publisher": "The International Union of Pure and Applied Chemistry", "keywords": ["Solubility", "Solubility data series"], "toc": ["dc:creator", "dc:rights", "dc:source", "sdo:chemical", "sdo:condition", "sdo:constituent", "sdo:datagroup", "sdo:datapoint", "sdo:dataset", "sdo:datum", "sdo:methodology", "sdo:mixture", "sdo:numericvalue", "sdo:procedure", "sdo:quantity", "sdo:scidataFramework", "sdo:scientificData", "sdo:substance", "sdo:system"], "ids": ["afrl:0000269", "afrl:0000270", "obo:NCIT_C25206", "qudt:K", "sdo:numericvalue", "w3i:Chemistry", "w3i:PhysicalChemistry", "xsd:float"], "scidata": {"@id": "scidata/", "@type": "sdo:scientificData", "discipline#": "w3i:Chemistry", "subdiscipline#": "w3i:PhysicalChemistry", "methodology": {"@id": "methodology/", "@type": "sdo:methodology", "aspects": [{"@id": "procedure/1/", "@type": "sdo:procedure", "description": "10 mL of (2) were placed along with 4-10 drops (1) in 10 mL serum bottles, which were then tightly capped, and placed in the rotating basket and rotated for 24 hours. The bottles were then hand shaken to remove (1) droplets from the stoppers and then replaced in the bath with 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.", "references": []}]}, "system": {"@id": "system/", "@type": "sdo:system", "facets": [{"@id": "substance/1/", "@type": "sdo:substance", "name": "Water", "formula": "H2O", "casrn": "7732-18-5", "iupacname": "oxidane", "inchikey": "XLYOFNOQVPJJNP-UHFFFAOYSA-N"}, {"@id": "substance/2/", "@type": "sdo:substance", "name": "1,4-Cyclohexadiene", "formula": "C6H8", "casrn": "628-41-1", "iupacname": "cyclohexa-1,4-diene", "inchikey": "UVJHQYIOXKWHFD-UHFFFAOYSA-N"}, {"@id": "chemical/1/", "@type": "sdo:chemical", "name": "1,4-Cyclohexadiene", "description": "Columbia Organic Chemicals Co., Inc.; 99%; used as received.", "substance#": "substance/1/"}, {"@id": "chemical/2/", "@type": "sdo:chemical", "name": "Water", "description": "laboratory distilled water", "substance#": "substance/2/"}, {"@id": "mixture/1/", "@type": "sdo:mixture", "name": "1,4-Cyclohexadiene with Water", "type": "binary system", "constituents": [{"@id": "mixture/1/constituent/1/", "@type": "sdo:constituent", "chemical": "chemical 2", "chemical#": "chemical/2/", "role": "solvent", "role#": "afrl:0000269"}, {"@id": "mixture/1/constituent/2/", "@type": "sdo:constituent", "chemical": "chemical 1", "chemical#": "chemical/1/", "role": "solute", "role#": "afrl:0000270"}]}, {"@id": "quantity/1/", "@type": "sdo:quantity", "quantity": "Ambient temperature", "quantity#": "obo:NCIT_C25206", "unit": "Kelvin", "unit#": "qudt:K"}, {"@id": "condition/1/", "@type": "sdo:condition", "quantity#": "quantity/1/", "number": "2.7826e+02", "significand": 2.7826, "exponent": 2, "sigfigs": 5}, {"@id": "condition/2/", "@type": "sdo:condition", "quantity#": "quantity/1/", "number": "2.8836e+02", "significand": 2.8836, "exponent": 2, "sigfigs": 5}, {"@id": "condition/3/", "@type": "sdo:condition", "quantity#": "quantity/1/", "number": "2.9826e+02", "significand": 2.9826, "exponent": 2, "sigfigs": 5}, {"@id": "condition/4/", "@type": "sdo:condition", "quantity#": "quantity/1/", "number": "3.0836e+02", "significand": 3.0836, "exponent": 2, "sigfigs": 5}, {"@id": "condition/5/", "@type": "sdo:condition", "quantity#": "quantity/1/", "number": "3.1836e+02", "significand": 3.1836, "exponent": 2, "sigfigs": 5}]}, "dataset": {"@id": "dataset/", "@type": "sdo:dataset", "datagroup": [{"@id": "datagroup/1/", "@type": "sdo:datagroup", "label": "Datagroup 1", "mixture#": "mixture/1/", "datapoints": ["datapoint/1/", "datapoint/2/", "datapoint/3/", "datapoint/4/", "datapoint/5/"]}], "datapoint": [{"@id": "datapoint/1/", "@type": "sdo:datapoint", "uid": "37:156:001:001:001", "conditions#": ["condition/1/"], "data": [{"@id": "datapoint/1/datum/1/", "@type": "sdo:datum", "quantity": "Mole fraction - Liquid (1)", "value": {"@id": "datapoint/1/datum/1/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "1.915e-04", "significand": 1.915, "exponent": -4, "sigfigs": 4}}, {"@id": "datapoint/1/datum/2/", "@type": "sdo:datum", "quantity": "Relative mass - solution (1)", "value": {"@id": "datapoint/1/datum/2/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "8.519e-02", "significand": 8.519, "exponent": -2, "sigfigs": 4}}]}, {"@id": "datapoint/2/", "@type": "sdo:datapoint", "uid": "37:156:001:001:002", "conditions#": ["condition/2/"], "data": [{"@id": "datapoint/2/datum/1/", "@type": "sdo:datum", "quantity": "Mole fraction - Liquid (1)", "value": {"@id": "datapoint/2/datum/1/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "2.155e-04", "significand": 2.155, "exponent": -4, "sigfigs": 4}}, {"@id": "datapoint/2/datum/2/", "@type": "sdo:datum", "quantity": "Relative mass - solution (1)", "value": {"@id": "datapoint/2/datum/2/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "9.585e-02", "significand": 9.585, "exponent": -2, "sigfigs": 4}}]}, {"@id": "datapoint/3/", "@type": "sdo:datapoint", "uid": "37:156:001:001:003", "conditions#": ["condition/3/"], "data": [{"@id": "datapoint/3/datum/1/", "@type": "sdo:datum", "quantity": "Mole fraction - Liquid (1)", "value": {"@id": "datapoint/3/datum/1/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "2.105e-04", "significand": 2.105, "exponent": -4, "sigfigs": 4}}, {"@id": "datapoint/3/datum/2/", "@type": "sdo:datum", "quantity": "Relative mass - solution (1)", "value": {"@id": "datapoint/3/datum/2/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "9.362e-02", "significand": 9.362, "exponent": -2, "sigfigs": 4}}]}, {"@id": "datapoint/4/", "@type": "sdo:datapoint", "uid": "37:156:001:001:004", "conditions#": ["condition/4/"], "data": [{"@id": "datapoint/4/datum/1/", "@type": "sdo:datum", "quantity": "Mole fraction - Liquid (1)", "value": {"@id": "datapoint/4/datum/1/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "2.166e-04", "significand": 2.166, "exponent": -4, "sigfigs": 4}}, {"@id": "datapoint/4/datum/2/", "@type": "sdo:datum", "quantity": "Relative mass - solution (1)", "value": {"@id": "datapoint/4/datum/2/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "9.634e-02", "significand": 9.634, "exponent": -2, "sigfigs": 4}}]}, {"@id": "datapoint/5/", "@type": "sdo:datapoint", "uid": "37:156:001:001:005", "conditions#": ["condition/5/"], "data": [{"@id": "datapoint/5/datum/1/", "@type": "sdo:datum", "quantity": "Mole fraction - Liquid (1)", "value": {"@id": "datapoint/5/datum/1/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "2.271e-04", "significand": 2.271, "exponent": -4, "sigfigs": 4}}, {"@id": "datapoint/5/datum/2/", "@type": "sdo:datum", "quantity": "Relative mass - solution (1)", "value": {"@id": "datapoint/5/datum/2/value/1/", "@type": "sdo:numericvalue", "datatype": "xsd:float", "number": "1.0100e-01", "significand": 1.01, "exponent": -1, "sigfigs": 5}}]}]}}, "sources": [{"@id": "source/1/", "@type": "dc:source", "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."}, {"@id": "source/2/", "@type": "dc:source", "citation": "Solubility data from IUPAC SDS Volume 37 (page 196) - 1,4-Cyclohexadiene with Water", "url": "https://iupac.github.io/SolubilityDataSeries/volumes/SDS-37.pdf"}], "rights": [{"@id": "rights/1/", "@type": "dc:rights", "holder": "The International Union of Pure and Applied Chemistry (IUPAC)", "license": "https://creativecommons.org/licenses/by-nc/4.0/"}]}}