<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">3896</id>
  <title>T3D3841</title>
  <common-name>Fluazifop-P-butyl</common-name>
  <description>Fluazifop-P-butyl is an exogenous organic compound with the formula C19H20F3NO4 and an average molecular weight of 383.36 g/mol. It exists as a solid at room temperature. Fluazifop-P-butyl belongs to the 2-phenoxypropionic acid esters, a subclass of benzene and substituted derivatives within the organic compounds. This selective phenoxy herbicide is used as a general use pesticide for the postemergence control of annual and perennial grass weeds on soybeans, ornamentals, and other broad-leaved crops, including spinach, carrots, and potatoes. It is a distinct compound from fluazifop and fluazifop butyl, differing in both chemical structure and toxicity, though some formulations may contain fluazifop-butyl.

The compound is slightly toxic. Ingestion of a single dose can cause severe stomach and intestine disturbance, while large quantities may result in fatigue, dizziness, drowsiness, and loss of coordination in the central nervous system. Inhaling small amounts may cause severe lung congestion and vomiting. Recorded exposure routes include oral and inhalation, with the substance found in indoor air, drinking water, and floors. Fluazifop-P-butyl targets six proteins, including the Epidermal growth factor receptor (EGFR), Solute carrier organic anion transporter family member 1B1 (SLCO1B1), Cytochrome P450 1A2 (CYP1A2), and Cytochrome P450 2B6 (CYP2B6).</description>
  <cas>79241-46-6</cas>
  <pubchem-id>3033674</pubchem-id>
  <chemical-formula>C19H20F3NO4</chemical-formula>
  <weight nil="true"/>
  <appearance>White powder.</appearance>
  <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>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source>This is a man-made compound that is used as a pesticide.</use-source>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2013-04-25T07:56:51Z</created-at>
  <updated-at type="dateTime">2026-04-06T04:06:37Z</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>CCCCOC(=O)[C@@H](C)OC1=CC=C(OC2=CC=C(C=N2)C(F)(F)F)C=C1</moldb-smiles>
  <moldb-formula>C19H20F3NO4</moldb-formula>
  <moldb-inchi>InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1</moldb-inchi>
  <moldb-inchikey>VAIZTNZGPYBOGF-CYBMUJFWSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">383.3616</moldb-average-mass>
  <moldb-mono-mass type="decimal">383.134442748</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Solid</state>
  <logp nil="true"/>
  <hmdb-id nil="true"/>
  <chembl-id>CHEMBL1864569</chembl-id>
  <chemspider-id>2298297</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></synthesis-reference>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM002802</chemdb-id>
  <dsstox-id>DTXSID0034855</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id>NS00098605</susdat-id>
  <iupac nil="true"/>
  <moldb-polar-surface-area>57.650000000000006</moldb-polar-surface-area>
  <moldb-refractivity>92.11350000000004</moldb-refractivity>
  <moldb-polarizability>36.70643978731807</moldb-polarizability>
  <moldb-rotatable-bond-count>10</moldb-rotatable-bond-count>
  <moldb-acceptor-count>3</moldb-acceptor-count>
  <moldb-donor-count>0</moldb-donor-count>
  <moldb-pka-strongest-acidic nil="true"/>
  <moldb-pka-strongest-basic>0.7973823359380259</moldb-pka-strongest-basic>
  <moldb-physiological-charge>0</moldb-physiological-charge>
  <moldb-number-of-rings>2</moldb-number-of-rings>
  <moldb-alogps-logp>4.86</moldb-alogps-logp>
  <moldb-alogps-logs>-5.09</moldb-alogps-logs>
  <moldb-alogps-solubility>3.09e-03 g/l</moldb-alogps-solubility>
  <kingdom>Organic compounds</kingdom>
  <superklass>Benzenoids</superklass>
  <klass>Benzene and substituted derivatives</klass>
  <subklass>2-phenoxypropionic acid esters</subklass>
  <paper-count type="integer">160</paper-count>
  <sync-id>CED0016401</sync-id>
  <structure-inchikey>VAIZTNZGPYBOGF-CYBMUJFWSA-N</structure-inchikey>
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  <structure-pattern-fingerprint>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</structure-pattern-fingerprint>
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  <structure-indexed-at type="dateTime">2026-09-19T04:00:58Z</structure-indexed-at>
</compound>
