<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">79465</id>
  <title nil="true"/>
  <common-name>M-(Benzyloxy)toluene</common-name>
  <description>M-(Benzyloxy)toluene belongs to the phenol ethers, a class of benzenoids within the organic compounds. This compound has the formula C14H14O1 and an average molecular weight of 198.26 g/mol.</description>
  <cas>834-17-3</cas>
  <pubchem-id>70035</pubchem-id>
  <chemical-formula>C14H14O1</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">2026-04-04T14:19:50Z</created-at>
  <updated-at type="dateTime">2026-04-04T14:19:50Z</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>CC1=CC(OCC2=CC=CC=C2)=CC=C1</moldb-smiles>
  <moldb-formula>C14H14O1</moldb-formula>
  <moldb-inchi>InChI=1S/C14H14O/c1-12-6-5-9-14(10-12)15-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3</moldb-inchi>
  <moldb-inchikey>FRQUHSBKTAMSDF-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">198.265</moldb-average-mass>
  <moldb-mono-mass type="decimal">198.104465</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>63225</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>CHEM075358</chemdb-id>
  <dsstox-id>DTXSID30232317</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00038253</susdat-id>
  <iupac>1-methyl-3-phenylmethoxybenzene</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>Benzenoids</superklass>
  <klass>Phenol ethers</klass>
  <subklass nil="true"/>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0121008</sync-id>
  <structure-inchikey>FRQUHSBKTAMSDF-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>800000100000000000000000000000000000000000000000000000000000200000000000000004000000000000000000000000000000000000000000200000000000200000000002000000000100000000000040000000000000000000000000000000100000000000000000000000000000000004000001000140200000800000000000000000000000000100000000000000000000000000000000000000000000080000000000000000080000000000040000000000000000000000000000000000000000000000000000002000000220000000000000000100000000000040000000000000000000000000000000000000000020</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`������@(������@h�������@(�������(�������`������@(������@h�������@h�������@h�������@h�������@h�������@h�������@h�������@h������������h���h��� ��������h���h��	h�	
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�h���h��h��h���h���h�B�������������	
������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:26:39Z</structure-indexed-at>
</compound>
