23480 <common-name>Tymazoline</common-name> <description>Tymazoline belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. This compound has the formula C14H20N2O and an average molecular weight of 232.32 g/mol.</description> <cas>24243-97-8</cas> <pubchem-id>34154</pubchem-id> <chemical-formula>C14H20N2O</chemical-formula> <weight>232.32</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">2016-05-25T18:30:23Z</created-at> <updated-at type="dateTime">2026-08-19T06:51:49Z</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>DB08803</drugbank-id> <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>CC(C)C1=C(OCC2=NCCN2)C=C(C)C=C1</moldb-smiles> <moldb-formula>C14H20N2O</moldb-formula> <moldb-inchi>InChI=1S/C14H20N2O/c1-10(2)12-5-4-11(3)8-13(12)17-9-14-15-6-7-16-14/h4-5,8,10H,6-7,9H2,1-3H3,(H,15,16)</moldb-inchi> <moldb-inchikey>QRORCRWSRPKEHR-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">232.3214</moldb-average-mass> <moldb-mono-mass type="decimal">232.157563272</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.64</logp> <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>CHEM022375</chemdb-id> <dsstox-id>DTXSID40178939</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00068084</susdat-id> <iupac>2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-4,5-dihydro-1H-imidazole</iupac> <moldb-polar-surface-area>33.62</moldb-polar-surface-area> <moldb-refractivity>69.5415</moldb-refractivity> <moldb-polarizability>27.2930740730135</moldb-polarizability> <moldb-rotatable-bond-count>4</moldb-rotatable-bond-count> <moldb-acceptor-count>3</moldb-acceptor-count> <moldb-donor-count>1</moldb-donor-count> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic>7.658453260346002</moldb-pka-strongest-basic> <moldb-physiological-charge>1</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>3.20</moldb-alogps-logp> <moldb-alogps-logs>-3.29</moldb-alogps-logs> <moldb-alogps-solubility>1.18e-01 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Lipids and lipid-like molecules</superklass> <klass>Prenol lipids</klass> <subklass>Monoterpenoids</subklass> <paper-count type="integer">6</paper-count> <sync-id>CED0040629</sync-id> <structure-inchikey>QRORCRWSRPKEHR-UHFFFAOYSA-N</structure-inchikey> 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<structure-indexed-at type="dateTime">2026-09-19T04:09:19Z</structure-indexed-at> </compound>