<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">63682</id>
  <title nil="true"/>
  <common-name>Cyclopentylacetic acid</common-name>
  <description nil="true"/>
  <cas>1123-00-8</cas>
  <pubchem-id>71606</pubchem-id>
  <chemical-formula>C7H12O2</chemical-formula>
  <weight>128.17</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">2026-04-03T01:41:49Z</created-at>
  <updated-at type="dateTime">2026-08-23T19:17:51Z</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>OC(=O)CC1CCCC1</moldb-smiles>
  <moldb-formula>C7H12O2</moldb-formula>
  <moldb-inchi>InChI=1S/C7H12O2/c8-7(9)5-6-3-1-2-4-6/h6H,1-5H2,(H,8,9)</moldb-inchi>
  <moldb-inchikey>YVHAIVPPUIZFBA-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">128.171</moldb-average-mass>
  <moldb-mono-mass type="decimal">128.08373</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>1.9</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>63457</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>CHEM059575</chemdb-id>
  <dsstox-id>DTXSID30149976</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00015791</susdat-id>
  <iupac>2-cyclopentylacetic 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>Carboxylic acids and derivatives</klass>
  <subklass>Carboxylic acids</subklass>
  <paper-count type="integer">27</paper-count>
  <sync-id>CED0027734</sync-id>
  <structure-inchikey>YVHAIVPPUIZFBA-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>4000000000000800000000000000000000000000000000001000000000000000000000000000000000000000004000000000000000000000008000000000000000000000000000000000000000020000000000000000000000000000000000000010000000000000000000020000000020000000000000000000800100800000000000000000000000000000000000000000000000000000000000000000000000004000000000000000000000000000000000000000000000000000000000000000000000008000000000000000000000000000000402000000000000000000000000000000000000000000400000000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>20000206000800000000002000000000000104000000200040000000044000000000800000000001000000000004200084000c00010000442000a0000080110000001000000000002000420100000000004001000200000020000009000c2000000000020020000000402000002000801000046004110800200010000200440000044000000800000088080000100400024440000000040800000000050041000000004000000008000024001002c0000000000800080000000000000000000004040000000080000000000000000000000000402000000004080000000000080000000000000000000000000000000000004000080000000050000000</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ����������������	���	���€���h��������(�������(�������`�������`�������`�������`�������`�������`�������� ��(����������������������B��������������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:16:23Z</structure-indexed-at>
</compound>
