<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">121171</id>
  <title nil="true"/>
  <common-name>Phenethylamine, alpha,N-dimethyl-m-trifluoromethyl-</common-name>
  <description>Phenethylamine, alpha,N-dimethyl-m-trifluoromethyl- belongs to the phenethylamines, a subclass of benzene and substituted derivatives within the organic compounds. It is a member of the benzenoids superclass with the formula C11H14F3N and an average molecular weight of 217.24 g/mol.</description>
  <cas>61471-62-3</cas>
  <pubchem-id>3044050</pubchem-id>
  <chemical-formula>C11H14F3N</chemical-formula>
  <weight>217.23</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">2026-04-06T03:47:50Z</created-at>
  <updated-at type="dateTime">2026-08-18T10:09:04Z</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>CNC(C)CC1=CC(=CC=C1)C(F)(F)F</moldb-smiles>
  <moldb-formula>C11H14F3N</moldb-formula>
  <moldb-inchi>InChI=1S/C11H14F3N/c1-8(15-2)6-9-4-3-5-10(7-9)11(12,13)14/h3-5,7-8,15H,6H2,1-2H3</moldb-inchi>
  <moldb-inchikey>WAUORSZPKUHOSM-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">217.235</moldb-average-mass>
  <moldb-mono-mass type="decimal">217.1078341</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3</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>CHEM117064</chemdb-id>
  <dsstox-id>DTXSID90977035</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00097789</susdat-id>
  <iupac>N-methyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine</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>Benzene and substituted derivatives</klass>
  <subklass>Phenethylamines</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0110844</sync-id>
  <structure-inchikey>WAUORSZPKUHOSM-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000001800000002000000000000000400000000000000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000004000000000000000100000000000000000000000000000000000000001000040200000800000000000000080000000000000000000000000080000000000000000000000000080080000000040020000040000000000000000200000000000000000000000000000000000000000000000000080000220000000000000000000000000000040000000100000800000000000000200000060010000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`������@(������@h�������@(������@h�������@h�������@h�������� ����	� ����	� ����	� ����������������������h���h���h��	h�	
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	�������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:44:52Z</structure-indexed-at>
</compound>
