289359 <common-name>2,2-difluoro-2-[4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]azepan-4-yl]acetic acid</common-name> <description>2,2-difluoro-2-[4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]azepan-4-yl]acetic acid is a chemical compound with the formula C13H21F2NO5. It has an average molecular weight of 309.31 g/mol.</description> <cas>2174002-55-0</cas> <pubchem-id>132388284</pubchem-id> <chemical-formula>C13H21F2NO5</chemical-formula> <weight>309.31</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">2026-08-28T02:49:15Z</created-at> <updated-at type="dateTime">2026-08-28T02:49:15Z</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)OC(=O)N1CCCC(CC1)(C(C(=O)O)(F)F)O</moldb-smiles> <moldb-formula>C13H21F2NO5</moldb-formula> <moldb-inchi>InChI=1S/C13H21F2NO5/c1-11(2,3)21-10(19)16-7-4-5-12(20,6-8-16)13(14,15)9(17)18/h20H,4-8H2,1-3H3,(H,17,18)</moldb-inchi> <moldb-inchikey>UCSZCWLALJIGJM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">309.1387791</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.9</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>CHEM285252</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>2,2-difluoro-2-[4-hydroxy-1-[(2-methylpropan-2-yl)oxycarbonyl]azepan-4-yl]acetic 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 nil="true"/> <superklass nil="true"/> <klass nil="true"/> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0241052</sync-id> <structure-inchikey>UCSZCWLALJIGJM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>1000000002000040000000000000000000000010000000000000000000000000000000000400004800000000000000000000400000000000000000080000080000000000000000020000000000100000000000001000000000000210000000000000000000000000000020100000000000000000000000840000048400000000000000000000020200000000000000000000000000010000000000000000000000000000000000000000000040000008000000000000000001000020000000000000000000000000000000000800000000000000000000000000000000000100000000000000400800200000000400000004000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAVAAAAFQAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAQMGAGAAAAABAwgAKAAAAAMCBgAoAAAAAwQIACgAAAADAgcAKAAA AAMDBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgAgAAAABAYAYAAAAAICBgBg AAAAAgIGACAAAAAEBgAoAAAAAwQIACgAAAADAggAaAAAAAMBAQkAIAAAAAEJ ACAAAAABCABgAAAAAQELAAEAAQIAAQMAAQQABAUgBQYoAgUHIAcIAAgJAAkK AAoLAAsMAAwNAAsOAA4PAA8QKAIPESAOEgAOEwALFAANBwBCAQAAAAcHCAkK CwwNFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:02:16Z</structure-indexed-at> </compound>