60858 <common-name>2-Chloro-1-fluoro-4-(prop-2-en-1-yl)benzene</common-name> <description>2-Chloro-1-fluoro-4-(prop-2-en-1-yl)benzene belongs to the halobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. It is a member of the benzenoids superclass with the chemical formula C9H8Cl1F1 and an average molecular weight of 170.61 g/mol.</description> <cas>121626-73-1</cas> <pubchem-id>2757597</pubchem-id> <chemical-formula>C9H8Cl1F1</chemical-formula> <weight>170.61</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">2026-03-26T23:59:43Z</created-at> <updated-at type="dateTime">2026-08-25T20:54:57Z</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>FC1=C(Cl)C=C(CC=C)C=C1</moldb-smiles> <moldb-formula>C9H8Cl1F1</moldb-formula> <moldb-inchi>InChI=1S/C9H8ClF/c1-2-3-7-4-5-9(11)8(10)6-7/h2,4-6H,1,3H2</moldb-inchi> <moldb-inchikey>LUVULFUQRHJDGP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">170.61</moldb-average-mass> <moldb-mono-mass type="decimal">170.029856</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.7</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>2038357</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>CHEM056751</chemdb-id> <dsstox-id>DTXSID00373963</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00005751</susdat-id> <iupac>2-chloro-1-fluoro-4-prop-2-enylbenzene</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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Halobenzenes</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0159822</sync-id> <structure-inchikey>LUVULFUQRHJDGP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000000000000000000000080000000000000000000000200000000000002000000000000000000000000400000000000000000000000400000000000000100000000000000000210000000000000000000000000000000000000000000100000000000000008020000000000000000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000200080000000000000000000000000080000000000000000000000000000000000000840000000010000000000000080220000000000000000000008000000040000000000000800000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAALAAAACwAAAIABCQAgAAAAAQZAKAAAAAME BkAoAAAAAwQRACAAAAABBkBoAAAAAwMBBkAoAAAAAwQGAGAAAAACAgYAaAAA AAMDAQYAaAAAAAMCAgZAaAAAAAMDAQZAaAAAAAMDAQsAAQABAmgMAgMAAgRo DAQFaAwFBgAGBwAHCAgCBQloDAkKaAwKAWgMQgEAAAAGAQoJBQQCFwQAAAAA AAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:14:29Z</structure-indexed-at> </compound>