95247 <common-name>[Carbonylbis[nitrilobis(methylene)]]tetrakisphosphonic acid</common-name> <description>[Carbonylbis[nitrilobis(methylene)]]tetrakisphosphonic acid belongs to the organic phosphonic acids, a subclass of organic phosphonic acids and derivatives within the organic compounds. It has the chemical formula C5H16N2O13P4 and an average molecular weight of 436.08 g/mol.</description> <cas>67923-76-6</cas> <pubchem-id>106155</pubchem-id> <chemical-formula>C5H16N2O13P4</chemical-formula> <weight>436.08</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">2026-04-05T03:15:56Z</created-at> <updated-at type="dateTime">2026-09-01T07:57:19Z</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>OP(O)(=O)CN(CP(O)(O)=O)C(=O)N(CP(O)(O)=O)CP(O)(O)=O</moldb-smiles> <moldb-formula>C5H16N2O13P4</moldb-formula> <moldb-inchi>InChI=1/C5H16N2O13P4/c8-5(6(1-21(9,10)11)2-22(12,13)14)7(3-23(15,16)17)4-24(18,19)20/h1-4H2,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20)</moldb-inchi> <moldb-inchikey>QVOBKEISBGYEOZ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">436.079</moldb-average-mass> <moldb-mono-mass type="decimal">435.9602851</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>-7.2</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>CHEM091140</chemdb-id> <dsstox-id>DTXSID6070855</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00057192</susdat-id> <iupac>[bis(phosphonomethyl)carbamoyl-(phosphonomethyl)amino]methylphosphonic acid</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>Organic acids and derivatives</superklass> <klass>Organic phosphonic acids and derivatives</klass> <subklass>Organic phosphonic acids</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0078563</sync-id> <structure-inchikey>QVOBKEISBGYEOZ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000000800000000000000000000000000080000000000000000000000000000000000000000000000000000000000000000000000002000000000000000000000000000000000000000020000000000000000000000000000000000000010000000000000000004000000000000000000000002000000000000080000000000000000000000000000000000000000000000000000000000000000000000000020000000000000000000000000800000000000000000000000000000000000000000000000400008000000000000000000000000000000000000001000000020000000000000000000400000000000000000000000000000000</structure-fingerprint> 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