<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">140435</id>
  <title nil="true"/>
  <common-name>Trimethylene carbonate</common-name>
  <description>Trimethylene carbonate is an organic compound with the chemical formula C4H6O3 and an average molecular weight of 102.09 g/mol. Trimethylene carbonate belongs to the 1,3-dioxanes, a subclass of dioxanes within the organic compounds. It is categorized under the superclass of organoheterocyclic compounds.

This substance has been identified in or released from seven recorded sources across various sectors. In building and construction, it is associated with ceilings, stairs, and ramps. Within electrical and electronic equipment, it is found in amplifiers and coils. Its presence is also noted in food, food processing, and cookware, specifically regarding the processing of meats. Additionally, trimethylene carbonate is linked to household cleaning and consumer products, such as soap dispensers, as well as common household items including coins.</description>
  <cas>2453-03-4</cas>
  <pubchem-id>123834</pubchem-id>
  <chemical-formula>C4H6O3</chemical-formula>
  <weight>102.09</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">2026-04-15T16:30:49Z</created-at>
  <updated-at type="dateTime">2026-08-22T18:14:23Z</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>DB19116</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>O=C1OCCCO1</moldb-smiles>
  <moldb-formula>C4H6O3</moldb-formula>
  <moldb-inchi>InChI=1S/C4H6O3/c5-4-6-2-1-3-7-4/h1-3H2</moldb-inchi>
  <moldb-inchikey>YFHICDDUDORKJB-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">102.089</moldb-average-mass>
  <moldb-mono-mass type="decimal">102.031694053</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>0.7</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>CHEM136328</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>1,3-dioxan-2-one</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>Organoheterocyclic compounds</superklass>
  <klass>Dioxanes</klass>
  <subklass>1,3-dioxanes</subklass>
  <paper-count type="integer">2365</paper-count>
  <sync-id>CED0006085</sync-id>
  <structure-inchikey>YFHICDDUDORKJB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>20000000000000000000000000000000000000000000000000020000000000000000000000000000000400000000000000000000000000000000000000000000000000020800000000000000000000000000000000000000000000000000000000000000000020000020000000000000000000800000000000010000000000000000000000000000000000000000000000000000000000000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000010000000000100000000000000000000000000000000800000000</structure-fingerprint>
  <structure-pattern-fingerprint>60000000000000000000000000000040300000000400000000000000000088000000020010000000000242000200004200080004420002000008011008002000000000000000042000000000100400000020000000000000900002000060000000000000000602000002000001000002000110800000011000200440000040000000800000008000000100c000244000000000c0800000000000041000000000000000008000000000002c0000000400840000000000000001000000000040800000100000000000000000000000000400000000000080000000000080000000000000000000000008000000000004000020000000050000000</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���(�������(�������(�������`�������`�������`�������(��������(��� �������������� B���������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:51:19Z</structure-indexed-at>
</compound>
