6040 <common-name>CALCIUM ACETATE</common-name> <description nil="true"/> <cas>62-54-4</cas> <pubchem-id>6116</pubchem-id> <chemical-formula>C4H6CaO4</chemical-formula> <weight>158.17</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">2016-05-19T01:56:27Z</created-at> <updated-at type="dateTime">2026-05-14T16:24:59Z</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>DB00258</drugbank-id> <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>[Ca++].CC([O-])=O.CC([O-])=O</moldb-smiles> <moldb-formula>C4H6CaO4</moldb-formula> <moldb-inchi>InChI=1S/2C2H4O2.Ca/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2</moldb-inchi> <moldb-inchikey>VSGNNIFQASZAOI-UHFFFAOYSA-L</moldb-inchikey> <moldb-average-mass type="decimal">158.166</moldb-average-mass> <moldb-mono-mass type="decimal">157.989199835</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-0.22</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>CHEM004935</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>calcium diacetate</iupac> <moldb-polar-surface-area>40.129999999999995</moldb-polar-surface-area> <moldb-refractivity>23.4808</moldb-refractivity> <moldb-polarizability>4.956147569023997</moldb-polarizability> <moldb-rotatable-bond-count>0</moldb-rotatable-bond-count> <moldb-acceptor-count>2</moldb-acceptor-count> <moldb-donor-count>0</moldb-donor-count> <moldb-pka-strongest-acidic>4.543439679000835</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge>-1</moldb-physiological-charge> <moldb-number-of-rings>0</moldb-number-of-rings> <moldb-alogps-logp>0.24</moldb-alogps-logp> <moldb-alogps-logs>-0.03</moldb-alogps-logs> <moldb-alogps-solubility>1.47e+02 g/l</moldb-alogps-solubility> </compound>