7921 <common-name>MINTLACTONE</common-name> <description>MINTLACTONE is an organic compound with the formula C10H14O2 and an average molecular weight of 166.22 g/mol. MINTLACTONE belongs to the benzofurans, a class of organoheterocyclic compounds within the organic compounds. In industrial applications, the compound is used as a fragrance, as well as a flavouring and nutrient. It has been recorded as being found in or released from household cleaning and consumer products, specifically other smoking requisites.</description> <cas>13341-72-5</cas> <pubchem-id>94349</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">2016-05-19T02:17:59Z</created-at> <updated-at type="dateTime">2026-08-18T01:07:14Z</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>CC1CCC2=C(C)C(=O)OC2C1</moldb-smiles> <moldb-formula>C10H14O2</moldb-formula> <moldb-inchi>InChI=1S/C10H14O2/c1-6-3-4-8-7(2)10(11)12-9(8)5-6/h6,9H,3-5H2,1-2H3</moldb-inchi> <moldb-inchikey>VUVQBYIJRDUVHT-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>1.9</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>85151</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>CHEM006816</chemdb-id> <dsstox-id>DTXSID90884593</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00013204</susdat-id> <iupac>3,6-dimethyl-5,6,7,7a-tetrahydro-4H-1-benzofuran-2-one</iupac> <moldb-polar-surface-area>26.3</moldb-polar-surface-area> <moldb-refractivity>46.176700000000004</moldb-refractivity> <moldb-polarizability>18.454261380943557</moldb-polarizability> <moldb-rotatable-bond-count>0</moldb-rotatable-bond-count> <moldb-acceptor-count>1</moldb-acceptor-count> <moldb-donor-count>0</moldb-donor-count> <moldb-pka-strongest-acidic>15.3174497753173</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>-6.88372860506763</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>2</moldb-number-of-rings> <moldb-alogps-logp>2.26</moldb-alogps-logp> <moldb-alogps-logs>-1.52</moldb-alogps-logs> <moldb-alogps-solubility>5.00e+00 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Organoheterocyclic compounds</superklass> <klass>Benzofurans</klass> <subklass nil="true"/> <paper-count type="integer">16</paper-count> <sync-id>CED0025511</sync-id> <structure-inchikey>VUVQBYIJRDUVHT-UHFFFAOYSA-N</structure-inchikey> 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</compound>