46617 <common-name>2'-[2,4-dichloro-5-(1-methylethoxy)phenyl]-2,2-dimethylpropionohydrazide</common-name> <description nil="true"/> <cas>51167-18-1</cas> <pubchem-id>6452357</pubchem-id> <chemical-formula>C14H20Cl2N2O2</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">2016-06-03T13:22:40Z</created-at> <updated-at type="dateTime">2026-03-31T17:28:33Z</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)OC1=C(Cl)C=C(Cl)C(NN=C(O)C(C)(C)C)=C1</moldb-smiles> <moldb-formula>C14H20Cl2N2O2</moldb-formula> <moldb-inchi>InChI=1S/C14H20Cl2N2O2/c1-8(2)20-12-7-11(9(15)6-10(12)16)17-18-13(19)14(3,4)5/h6-8,17H,1-5H3,(H,18,19)</moldb-inchi> <moldb-inchikey>IRVAUMHWBDVRPH-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">319.23</moldb-average-mass> <moldb-mono-mass type="decimal">318.0901833</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>4954791</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>CHEM045512</chemdb-id> <dsstox-id>DTXSID10199191</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin>REACH</stoff-ident-origin> <stoff-ident-id>SI00008370</stoff-ident-id> <susdat-id>NS00009045</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>53.85000000000001</moldb-polar-surface-area> <moldb-refractivity>83.61080000000001</moldb-refractivity> <moldb-polarizability>33.009800924387804</moldb-polarizability> <moldb-rotatable-bond-count>5</moldb-rotatable-bond-count> <moldb-acceptor-count>4</moldb-acceptor-count> <moldb-donor-count>2</moldb-donor-count> <moldb-pka-strongest-acidic>4.639441070593481</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic>2.1589914627187046</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>1</moldb-number-of-rings> <moldb-alogps-logp>5.23</moldb-alogps-logp> <moldb-alogps-logs>-4.78</moldb-alogps-logs> <moldb-alogps-solubility>5.30e-03 g/l</moldb-alogps-solubility> </compound>