<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">7525</id>
  <title nil="true"/>
  <common-name>1-MENTHYL METHYL ETHER</common-name>
  <description>1-MENTHYL METHYL ETHER is an organic compound with the formula C11H22O and an average molecular weight of 170.29 g/mol. 1-MENTHYL METHYL ETHER belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds.

Industrially, this compound is utilized as a fragrance, as well as a flavouring and nutrient. It has been recorded in two sources, specifically within household cleaning and consumer products such as tobacco product cases and soap dispensers.</description>
  <cas>1565-76-0</cas>
  <pubchem-id>102648</pubchem-id>
  <chemical-formula>C11H22O</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">2016-05-19T02:13:27Z</created-at>
  <updated-at type="dateTime">2026-04-04T22:12:06Z</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>COC1CC(C)CCC1C(C)C</moldb-smiles>
  <moldb-formula>C11H22O</moldb-formula>
  <moldb-inchi>InChI=1S/C11H22O/c1-8(2)10-6-5-9(3)7-11(10)12-4/h8-11H,5-7H2,1-4H3</moldb-inchi>
  <moldb-inchikey>JDGJLPHFRJNJMN-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">170.2918</moldb-average-mass>
  <moldb-mono-mass type="decimal">170.167065326</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>CHEM006420</chemdb-id>
  <dsstox-id>DTXSID60883694</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00047941</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>9.23</moldb-polar-surface-area>
  <moldb-refractivity>52.19650000000001</moldb-refractivity>
  <moldb-polarizability>21.715582114404725</moldb-polarizability>
  <moldb-rotatable-bond-count>2</moldb-rotatable-bond-count>
  <moldb-acceptor-count>1</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>-4.124674133154516</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>1</moldb-number-of-rings>
  <moldb-alogps-logp>3.62</moldb-alogps-logp>
  <moldb-alogps-logs>-4.47</moldb-alogps-logs>
  <moldb-alogps-solubility>5.82e-03 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">0</paper-count>
  <sync-id>CED0031554</sync-id>
  <structure-inchikey>JDGJLPHFRJNJMN-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000400000000000000000000000000000000000000000040000401000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000100000000000000000000000002000000000040000000000000000000020040000000000000000800100000000040000000000000000020000800000000000000000000000000000000000800040004000000000008000080000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000002000000000000000100000000000000000000000000000000000200000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:02:55Z</structure-indexed-at>
</compound>
