<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">15031</id>
  <title nil="true"/>
  <common-name>1,1,2,2,3,3,4,4,5,5,5-Undecafluoro-N-methylpentane-1-sulfonamide</common-name>
  <description>1,1,2,2,3,3,4,4,5,5,5-Undecafluoro-N-methylpentane-1-sulfonamide belongs to the organosulfonic acids and derivatives, a subclass of organic sulfonic acids and derivatives within the organic compounds. This organic acid and derivative has the chemical formula C6H4F11NO2S and an average molecular weight of 363.15 g/mol.

The compound is associated with 13 recorded sources across several sectors. Within electrical and electronic equipment, it is found in cell phones, capacitors, batteries, printed circuit boards, and wires and cables. It is also present in textiles, leather and furnishings, specifically in carpets, rugs, and synthetic textiles. Other recorded sources include food packaging from the food, food processing and cookware sector, medical devices from healthcare, pharmaceuticals and veterinary products, and lubricants utilized in both energy, oil and gas as well as industrial manufacturing and chemical processing. Recorded exposure routes for this compound include oral, inhalation, and touch.</description>
  <cas>68298-13-5</cas>
  <pubchem-id>109969</pubchem-id>
  <chemical-formula>C6H4F11NO2S</chemical-formula>
  <weight>363.15</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">2016-05-19T04:20:35Z</created-at>
  <updated-at type="dateTime">2026-08-23T10:11:55Z</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>CNS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F</moldb-smiles>
  <moldb-formula>C6H4F11NO2S</moldb-formula>
  <moldb-inchi>InChI=1S/C6H4F11NO2S/c1-18-21(19,20)6(16,17)4(11,12)2(7,8)3(9,10)5(13,14)15/h18H,1H3</moldb-inchi>
  <moldb-inchikey>BKKNDZBSSSAGIB-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">363.15</moldb-average-mass>
  <moldb-mono-mass type="decimal">362.97870934</moldb-mono-mass>
  <origin nil="true"/>
  <state nil="true"/>
  <logp>3.2</logp>
  <hmdb-id nil="true"/>
  <chembl-id nil="true"/>
  <chemspider-id>98778</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>CHEM013926</chemdb-id>
  <dsstox-id>DTXSID6071374</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin>PubChem</stoff-ident-origin>
  <stoff-ident-id>SI00005132</stoff-ident-id>
  <susdat-id>NS00011241</susdat-id>
  <iupac>1,1,2,2,3,3,4,4,5,5,5-undecafluoro-N-methylpentane-1-sulfonamide</iupac>
  <moldb-polar-surface-area>46.17</moldb-polar-surface-area>
  <moldb-refractivity>43.40700000000001</moldb-refractivity>
  <moldb-polarizability>18.588552380914948</moldb-polarizability>
  <moldb-rotatable-bond-count>5</moldb-rotatable-bond-count>
  <moldb-acceptor-count>2</moldb-acceptor-count>
  <moldb-donor-count>1</moldb-donor-count>
  <moldb-pka-strongest-acidic>3.4714278330457513</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>3.61</moldb-alogps-logp>
  <moldb-alogps-logs>-3.70</moldb-alogps-logs>
  <moldb-alogps-solubility>7.21e-02 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Organic acids and derivatives</superklass>
  <klass>Organic sulfonic acids and derivatives</klass>
  <subklass>Organosulfonic acids and derivatives</subklass>
  <paper-count type="integer">0</paper-count>
  <sync-id>CED0158067</sync-id>
  <structure-inchikey>BKKNDZBSSSAGIB-UHFFFAOYSA-N</structure-inchikey>
  <structure-fingerprint>100000000000002000000000000010000000000000000000000000000000000000000000020000200000000000000000000000000000000000000000100000040000000000000000000020000000000000000000000000000000000000000000000000000000000200000008000000000000080040000000000000000040000000000000000000000080000000000200000000000000000000000010000000000000000000000002000000020000040000080000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000800000000000000000000000000000</structure-fingerprint>
  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
  <structure-pickle>ï¾­Þ������������������������€���`�������`������� ������(�������(������� ����	� ����	� ������ ����	� ����	� ������ ����	� ����	� ������ ����	� ����	� ������ ����	� ����	� ����	� ��������������������������������	��
������������������������������B��������������</structure-pickle>
  <structure-indexed-at type="dateTime">2026-09-19T04:05:33Z</structure-indexed-at>
</compound>
