123408 <common-name>2,2,3,3,4,4,4-Heptafluorobutanal--water (1/1)</common-name> <description>2,2,3,3,4,4,4-Heptafluorobutanal--water (1/1) is an organic compound with the formula C4H3F7O2 and an average molecular weight of 216.06 g/mol. 2,2,3,3,4,4,4-Heptafluorobutanal--water (1/1) belongs to the organofluorides, a class of organohalogen compounds within the organic compounds. This substance is found in or released from 13 recorded sources across several sectors. In the electrical and electronic equipment sector, it is associated with capacitors, cell phones, printed circuit boards, wires and cables, batteries, and one additional source. Within the textiles, leather and furnishings sector, it is linked to carpets, rugs, and synthetic textiles. It is also found in food packaging within the food, food processing and cookware sector, and in medical devices within the healthcare, pharmaceuticals and veterinary products sector. Additionally, the compound is found in lubricants used in both industrial manufacturing and chemical processing, as well as in the energy, oil and gas sector. One other sector is also recorded as a source. Recorded exposure routes for this compound include touch, oral, and inhalation.</description> <cas nil="true"/> <pubchem-id nil="true"/> <chemical-formula>C4H3F7O2</chemical-formula> <weight nil="true"/> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-04-06T06:46:01Z</created-at> <updated-at type="dateTime">2026-05-21T06:56:35Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>O.FC(F)(F)C(F)(F)C(F)(F)C=O</moldb-smiles> <moldb-formula>C4H3F7O2</moldb-formula> <moldb-inchi>InChI=1S/C4HF7O.H2O/c5-2(6,1-12)3(7,8)4(9,10)11;/h1H;1H2</moldb-inchi> <moldb-inchikey>SIFCGDJQLNEASB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">216.055</moldb-average-mass> <moldb-mono-mass type="decimal">216.0021269</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM119301</chemdb-id> <dsstox-id>DTXSID70622576</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00111257</susdat-id> <iupac>2,2,3,3,4,4,4-Heptafluorobutanal--water (1/1)</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organohalogen compounds</superklass> <klass>Organofluorides</klass> <subklass nil="true"/> <paper-count type="integer">0</paper-count> <sync-id>CED0079229</sync-id> <structure-inchikey>SIFCGDJQLNEASB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>100000000000002000000000000000000000000000000000000000000000000000008000008000000000000000000000000000000000000000000000000000000000000000000000000020000000000200000000000000000000000200000000000000000000000200000000000000000000000000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000002000000000000040000000080000000000000000000000000000000000000000000400000000000000000000000000000000000000000000000000000000000000000800000000020000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAANAAAACwAAAIABCABAAAAAAgkAIAAAAAEG ACAAAAAECQAgAAAAAQkAIAAAAAEGACAAAAAECQAgAAAAAQkAIAAAAAEGACAA AAAECQAgAAAAAQkAIAAAAAEGAGgAAAADAwEIACgAAAADAgsBAgACAwACBAAC BQAFBgAFBwAFCAAICQAICgAICwALDAgCQgAAAAAXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:46:36Z</structure-indexed-at> </compound>