8206 <common-name>PENTYL 2-FURYL KETONE</common-name> <description>PENTYL 2-FURYL KETONE is an organic compound with the formula C10H14O2 and an average molecular weight of 166.22 g/mol. PENTYL 2-FURYL KETONE belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. It is categorized under the superclass of organic oxygen compounds and the class of organooxygen compounds. In industrial applications, this substance is utilized as a nutrient and a flavouring.</description> <cas>14360-50-0</cas> <pubchem-id>61738</pubchem-id> <chemical-formula>C10H14O2</chemical-formula> <weight>166.22</weight> <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">2016-05-19T02:21:27Z</created-at> <updated-at type="dateTime">2026-08-18T01:06:52Z</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>CCCCCC(=O)C1=CC=CO1</moldb-smiles> <moldb-formula>C10H14O2</moldb-formula> <moldb-inchi>InChI=1S/C10H14O2/c1-2-3-4-6-9(11)10-7-5-8-12-10/h5,7-8H,2-4,6H2,1H3</moldb-inchi> <moldb-inchikey>YUAYWSBSIJVIBS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">166.217</moldb-average-mass> <moldb-mono-mass type="decimal">166.099379692</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.4</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>55631</chemspider-id> <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>CHEM007101</chemdb-id> <dsstox-id>DTXSID1065760</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00021658</susdat-id> <iupac>1-(furan-2-yl)hexan-1-one</iupac> <moldb-polar-surface-area>30.21</moldb-polar-surface-area> <moldb-refractivity>47.281600000000005</moldb-refractivity> <moldb-polarizability>18.903973989155375</moldb-polarizability> <moldb-rotatable-bond-count>5</moldb-rotatable-bond-count> <moldb-acceptor-count>1</moldb-acceptor-count> <moldb-donor-count>0</moldb-donor-count> <moldb-pka-strongest-acidic>15.423220205181334</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>-4.1791298485089445</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>1</moldb-number-of-rings> <moldb-alogps-logp>2.97</moldb-alogps-logp> <moldb-alogps-logs>-3.16</moldb-alogps-logs> <moldb-alogps-solubility>1.16e-01 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Carbonyl compounds</subklass> <paper-count type="integer">1</paper-count> <sync-id>CED0019391</sync-id> <structure-inchikey>YUAYWSBSIJVIBS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000000000000000000000000000000000000000002000000000000400000000000000000000000000000002000000000000000000000000000010000000400000020800000000000000000000000000000001020010000000000000000000000000000000000000000000000000000000000000060200000800000000000000000000000000000000000400000001000000000000000000000000000080000000000000008000000000000000000000000000008000000000000000000000000000000040000004000000220000000000000000000000000000040000000010402000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAMAAAADAAAAIABBgBgAAAAAQMGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAKAAAAAMECAAoAAAAAwIGQCgA AAADBAZAaAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQhAKAAAAAMCCwABAAEC AAIDAAMEAAQFAAUGKAIFByAHCGgMCAloDAkKaAwKC2gMCwdoDEIBAAAABQcI CQoLFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:03:12Z</structure-indexed-at> </compound>