99548 <common-name>7-Isopropyl-5-methylbicyclo[2.2.2]octane-2-carbaldehyde</common-name> <description>7-Isopropyl-5-methylbicyclo[2.2.2]octane-2-carbaldehyde belongs to the organic oxides, a class of organic oxygen compounds within the organic compounds. This compound has the chemical formula C13H22O and an average molecular weight of 194.32 g/mol.</description> <cas>84963-31-5</cas> <pubchem-id>53430933</pubchem-id> <chemical-formula>C13H22O</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">2026-04-05T06:55:39Z</created-at> <updated-at type="dateTime">2026-04-05T06:55:39Z</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)C1CC2CC(C=O)C1CC2C</moldb-smiles> <moldb-formula>C13H22O</moldb-formula> <moldb-inchi>InChI=1/C13H22O/c1-8(2)12-6-10-5-11(7-14)13(12)4-9(10)3/h7-13H,4-6H2,1-3H3</moldb-inchi> <moldb-inchikey>DFYLIPCZGDCPEB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">194.318</moldb-average-mass> <moldb-mono-mass type="decimal">194.1670653</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM095441</chemdb-id> <dsstox-id>DTXSID301005282</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00062407</susdat-id> <iupac nil="true"/> <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>Organic oxygen compounds</superklass> <klass>Organic oxides</klass> <subklass nil="true"/> <paper-count type="integer">0</paper-count> <sync-id>CED0175633</sync-id> <structure-inchikey>DFYLIPCZGDCPEB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40400000000000000000400000000000000000000000000000000000000000040000041000000000000000000000000000000400000000000000000000000000000000000000000000400000000200000020000000000200000800000000000000000000000000000000000000000000000000020000000000000000000800100400000040000000000000000000800000000000000810000000000001000000000800040000000000000008000000000000000000000000010000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000100000000000000000000000000000000020000000000000</structure-fingerprint> <structure-pattern-fingerprint>501000000102064080000840010820000000140001052000003520400204000c4802001012800000000001080080004004200024408d32010022443000a0401084110c08020004010090100000620200000005815100103240000522002058000c280007004002000000840044100008200680100001c0041108200002510002004000084c5802080800020008080008310d805244401402002008002040008000c100000000400002000948012c211002c000008941084010a0420008c0021000010084040000130180800004010280040000200200500005000200080001001010081000000000000000004110200000100010104000020000100050000200</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAOAAAADwAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAEDBgBgAAAAAwEGAGAAAAACAgYAYAAAAAMBBgBgAAAAAgIGAGAA AAADAQYAaAAAAAMDAQgAKAAAAAMCBgBgAAAAAwEGAGAAAAACAgYAYAAAAAMB BgBgAAAAAQMLAAEAAQIAAQMAAwQABAUABQYABgcABwgACAkIAgcKAAoLAAsM AAwNAAoDAAwFAEIDAAAABgMKBwYFBAYDCgsMBQQGBgcKCwwFFwQAAAAAAAAA Fg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:38:48Z</structure-indexed-at> </compound>