11885 <common-name>Benzene, 1-(1-methylethyl)-2-(1-phenylethyl)-</common-name> <description>Benzene, 1-(1-methylethyl)-2-(1-phenylethyl)- belongs to the diphenylmethanes, a subclass of benzene and substituted derivatives within the organic compounds. It is a benzenoid with the formula C17H20 and an average molecular weight of 224.34 g/mol.</description> <cas>191044-60-7</cas> <pubchem-id>13765184</pubchem-id> <chemical-formula>C17H20</chemical-formula> <weight>224.34</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">2016-05-19T03:27:58Z</created-at> <updated-at type="dateTime">2026-08-29T01:43:15Z</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=CC=CC=C1C(C)C2=CC=CC=C2</moldb-smiles> <moldb-formula>C17H20</moldb-formula> <moldb-inchi>InChI=1S/C17H20/c1-13(2)16-11-7-8-12-17(16)14(3)15-9-5-4-6-10-15/h4-14H,1-3H3</moldb-inchi> <moldb-inchikey>RVJXUBXQGJPVJW-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">224.1565006</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.3</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>CHEM010780</chemdb-id> <dsstox-id>DTXSID00889094</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00005695</susdat-id> <iupac>1-(1-phenylethyl)-2-propan-2-ylbenzene</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>Diphenylmethanes</subklass> <paper-count type="integer">35</paper-count> <sync-id>CED0025809</sync-id> <structure-inchikey>RVJXUBXQGJPVJW-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000000000000040000000000000000000000000000400000000001000000000000000000200000004000000000000000000000000000000000000000000000004000200000000000000000000000000000000000000000041000000000000000000000000000000000000000000000000000000000000000000000040000000800000000000000000000000000100000000000000000000000000000000000000000400080000000000000000000000000000000000000000000000000400000000000000000000000000000010000000000200000000000000000020000000000040000000000000000000000000000000000000000000</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�� � � ����h�� h� �h���h���h���h���h�B������������� ��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:04:39Z</structure-indexed-at> </compound>