<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">220123</id>
  <title nil="true"/>
  <common-name>1-methylsulfonylethane</common-name>
  <description>1-methylsulfonylethane (C3H8O2S) is an organic sulfur compound with an average molecular weight of 108.16 g/mol. 1-methylsulfonylethane belongs to the sulfones, a subclass of sulfonyls within the organic compounds. 

This compound is identified in or released from three recorded sources. These include food, food processing, and cookware, specifically during fermentation processes for beer. Additionally, it is associated with electrical and electronic equipment, such as antennas and electric hearing aids.</description>
  <cas>594-43-4</cas>
  <pubchem-id>79059</pubchem-id>
  <chemical-formula>C3H8O2S</chemical-formula>
  <weight>108.16</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">2026-08-22T13:49:53Z</created-at>
  <updated-at type="dateTime">2026-08-22T13:49:53Z</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 nil="true"/>
  <moldb-formula>C3H8O2S</moldb-formula>
  <moldb-inchi>InChI=1S/C3H8O2S/c1-3-6(2,4)5/h3H2,1-2H3</moldb-inchi>
  <moldb-inchikey>YBJCDTIWNDBNTM-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">108.16</moldb-average-mass>
  <moldb-mono-mass type="decimal">108.0245007</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0</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>CHEM216016</chemdb-id>
  <dsstox-id nil="true"/>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>1-methylsulfonylethane</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>Organosulfur compounds</superklass>
  <klass>Sulfonyls</klass>
  <subklass>Sulfones</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0175037</sync-id>
  <structure-inchikey nil="true"/>
  <structure-fingerprint nil="true"/>
  <structure-pattern-fingerprint nil="true"/>
  <structure-pickle nil="true"/>
  <structure-indexed-at nil="true"/>
</compound>
