90053 <common-name>(1A,2ß,4ß)-2-chloro-1-(isopropyl)-4-methylcyclohexane</common-name> <description>(1A,2ß,4ß)-2-chloro-1-(isopropyl)-4-methylcyclohexane belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. This compound has the formula C10H19Cl and an average molecular weight of 174.71 g/mol. It is classified under the superclass of lipids and lipid-like molecules.</description> <cas>29707-60-6</cas> <pubchem-id>10197918</pubchem-id> <chemical-formula>C10H19Cl</chemical-formula> <weight>174.71</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">2026-04-05T00:04:37Z</created-at> <updated-at type="dateTime">2026-08-26T19:04:23Z</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)[C@H]1CC[C@H](C)C[C@@H]1Cl</moldb-smiles> <moldb-formula>C10H19Cl</moldb-formula> <moldb-inchi>InChI=1/C10H19Cl/c1-7(2)9-5-4-8(3)6-10(9)11/h7-10H,4-6H2,1-3H3</moldb-inchi> <moldb-inchikey>OMLOJNNKKPNVKN-AEJSXWLSSA-N</moldb-inchikey> <moldb-average-mass type="decimal">174.71</moldb-average-mass> <moldb-mono-mass type="decimal">174.1175283</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.3</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>CHEM085946</chemdb-id> <dsstox-id>DTXSID50885460</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00051068</susdat-id> <iupac>(1R,2S,4S)-2-chloro-4-methyl-1-propan-2-ylcyclohexane</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>Lipids and lipid-like molecules</superklass> <klass>Prenol lipids</klass> <subklass>Monoterpenoids</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0164718</sync-id> <structure-inchikey>OMLOJNNKKPNVKN-AEJSXWLSSA-N</structure-inchikey> <structure-fingerprint>40000000000000002000400000000000000000000000000000000000000000040000001000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000020000000000000000000800100000000040000000000000000000000800000000000000000002000000000000000800040004000000000008000000000000000000000000000000000000000000000000000000000000000000000000000010000000000000000000000000000000002000000000020000100000000000000000808000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAALAAAACwAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAEDBiA0AAAAAQEEBgBgAAAAAgIGAGAAAAACAgYgNAAAAAIBBAYA YAAAAAEDBgBgAAAAAgIGIDQAAAACAQQRACAAAAABCwABAAECAAEDAAMEAAQF AAUGAAYHAAYIAAgJAAkKAAkDAEIBAAAABgMJCAYFBBcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:32:59Z</structure-indexed-at> </compound>