6467 <common-name>DIHYDRO-2,4,6-TRIS(2-METHYLPROPYL)-4H-1,3,5-DITHIAZINE</common-name> <description>DIHYDRO-2,4,6-TRIS(2-METHYLPROPYL)-4H-1,3,5-DITHIAZINE is an organic compound with the formula C15H31NS2 and an average molecular weight of 289.54 g/mol. DIHYDRO-2,4,6-TRIS(2-METHYLPROPYL)-4H-1,3,5-DITHIAZINE belongs to the dithiazinanes, a subclass of azacyclic compounds within the organic compounds. It is further classified as an organoheterocyclic compound. This substance is utilized as an industrial nutrient and flavouring.</description> <cas>74595-94-1</cas> <pubchem-id>46941523</pubchem-id> <chemical-formula>C15H31NS2</chemical-formula> <weight>289.5</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">2016-05-19T02:01:10Z</created-at> <updated-at type="dateTime">2026-08-19T13:12:52Z</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)CC1NC(CC(C)C)SC(CC(C)C)S1</moldb-smiles> <moldb-formula>C15H31NS2</moldb-formula> <moldb-inchi>InChI=1S/C15H31NS2/c1-10(2)7-13-16-14(8-11(3)4)18-15(17-13)9-12(5)6/h10-16H,7-9H2,1-6H3</moldb-inchi> <moldb-inchikey>RQGPQWUKHADVPF-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">289.543</moldb-average-mass> <moldb-mono-mass type="decimal">289.189791377</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.4</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>21106002</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>CHEM005362</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00010140</susdat-id> <iupac>2,4,6-tris(2-methylpropyl)-1,3,5-dithiazinane</iupac> <moldb-polar-surface-area>12.03</moldb-polar-surface-area> <moldb-refractivity>87.20179999999999</moldb-refractivity> <moldb-polarizability>36.10696318969489</moldb-polarizability> <moldb-rotatable-bond-count>6</moldb-rotatable-bond-count> <moldb-acceptor-count>1</moldb-acceptor-count> <moldb-donor-count>1</moldb-donor-count> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic>6.366979093845049</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>1</moldb-number-of-rings> <moldb-alogps-logp>4.91</moldb-alogps-logp> <moldb-alogps-logs>-5.11</moldb-alogps-logs> <moldb-alogps-solubility>2.26e-03 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Organoheterocyclic compounds</superklass> <klass>Azacyclic compounds</klass> <subklass>Dithiazinanes</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0051668</sync-id> <structure-inchikey>RQGPQWUKHADVPF-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000800000000000000800000000000000010000000000000000000000000000000001000000000000100000000000000000000000000000000000000000000800000000000000000000000000000000000000010000000000000000000000000000000000000040000000000000000000000000000000000000000000000100000000040000000000000200000000000000800000000000000000000000000000000000000200000000000000000000000000000000000000000000000000000000000000000000000000000001000000002000000020000200000000000000000000000000100000000000000000000000000000000000000001000000000</structure-fingerprint> 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<structure-indexed-at type="dateTime">2026-09-19T04:02:21Z</structure-indexed-at> </compound>