<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">284777</id>
  <title nil="true"/>
  <common-name>6-propan-2-yl-2,3-dihydro-1h-inden-1-amine</common-name>
  <description>6-propan-2-yl-2,3-dihydro-1h-inden-1-amine belongs to the indanes, a class of benzenoids within the organic compounds. This compound has the chemical formula C12H17N and an average molecular weight of 175.27 g/mol.</description>
  <cas>1082475-36-2</cas>
  <pubchem-id>54776100</pubchem-id>
  <chemical-formula>C12H17N</chemical-formula>
  <weight>175.27</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">2026-08-27T20:24:57Z</created-at>
  <updated-at type="dateTime">2026-08-27T20:24:57Z</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>CC(C)C1=CC2=C(CCC2N)C=C1</moldb-smiles>
  <moldb-formula>C12H17N</moldb-formula>
  <moldb-inchi>InChI=1S/C12H17N/c1-8(2)10-4-3-9-5-6-12(13)11(9)7-10/h3-4,7-8,12H,5-6,13H2,1-2H3</moldb-inchi>
  <moldb-inchikey>RMJKUZYESJIKTQ-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal" nil="true"/>
  <moldb-mono-mass type="decimal">175.1360995</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>2.3</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>CHEM280670</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>6-propan-2-yl-2,3-dihydro-1h-inden-1-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>Indanes</klass>
  <subklass nil="true"/>
  <paper-count type="integer" nil="true"/>
  <sync-id>CED0236627</sync-id>
  <structure-inchikey>RMJKUZYESJIKTQ-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>40000000000000000000000000000000000000001000000000000080000000000000001000000000000000000000000000000000000000000000000000000000000000000000000004100200000000000000000000000000004000000000000000000000000000000000000000100000000000020000000000000000000000101000000040000000000000000000000000001000000000000000080000000000000000000004000000000400080000000000000004000000000000000000000000000000000000000000000000000000000000000000000000200200000000002008000000800004000040000000000000200000000000080000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ�����������������������€���`�������`�������`������@(������@h�������@(������@(�������`�������`�������`�������`������@h�������@h������������������h���h���h��������	�	
���h���h���h�	��B���������������	�����������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:58:57Z</structure-indexed-at>
</compound>
