62146 <common-name>2-Diethoxymethyl-1-phenylhept-1-ene</common-name> <description>2-Diethoxymethyl-1-phenylhept-1-ene belongs to the benzene and substituted derivatives, a class of benzenoids within the organic compounds. This compound has the chemical formula C18H28O2 and an average molecular weight of 276.42 g/mol. Industrially, it is utilized as a fragrance.</description> <cas>60763-41-9</cas> <pubchem-id>5875676</pubchem-id> <chemical-formula>C18H28O2</chemical-formula> <weight>276.4</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">2026-03-31T21:31:16Z</created-at> <updated-at type="dateTime">2026-08-29T11:57:13Z</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>CCCCCC(=CC1=CC=CC=C1)C(OCC)OCC</moldb-smiles> <moldb-formula>C18H28O2</moldb-formula> <moldb-inchi>InChI=1S/C18H28O2/c1-4-7-9-14-17(18(19-5-2)20-6-3)15-16-12-10-8-11-13-16/h8,10-13,15,18H,4-7,9,14H2,1-3H3</moldb-inchi> <moldb-inchikey>MPKOLWUWOADQCX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">276.42</moldb-average-mass> <moldb-mono-mass type="decimal">276.20893</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.6</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>4730977</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>CHEM058039</chemdb-id> <dsstox-id>DTXSID9069429</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00011960</susdat-id> <iupac>[(E)-2-(diethoxymethyl)hept-1-enyl]benzene</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 nil="true"/> <paper-count type="integer">0</paper-count> <sync-id>CED0163573</sync-id> <structure-inchikey>MPKOLWUWOADQCX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000000000000000000000000000000000000000000001002000008000000000000008004000000000000000000000000000000000000000000000008010000000000000000000200000300000000000000000000000020010000100000000000000000000000000000000000000000000002000000000040000000800000000000000000000000000100000000024000001000000000000000000000400000080000000000000008000080000000000000000000000008000000000000000000000000000000000000000000002200000000000000000000000000000040000000010000000000000000000000000000004000</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�B�������� �����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:15:16Z</structure-indexed-at> </compound>