CHEBI:82017 - fluroxypyr

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ChEBI Name fluroxypyr
ChEBI ID CHEBI:82017
Definition An aminopyridine that is pyridin-4-amine substituted by chloro groups at positions 3 and 5, a fluoro group at position 6 and a carboxymethoxy group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C7H5Cl2FN2O3
Net Charge 0
Average Mass 255.03100
Monoisotopic Mass 253.966
InChI InChI=1S/C7H5Cl2FN2O3/c8-3-5(11)4(9)7(12-6(3)10)15-1-2(13)14/h1H2,(H2,11,12)(H,13,14)
InChIKey MEFQWPUMEMWTJP-UHFFFAOYSA-N
SMILES Nc1c(Cl)c(F)nc(OCC(O)=O)c1Cl
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application(s): herbicide
A substance used to destroy plant pests.
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ChEBI Ontology
Outgoing fluroxypyr (CHEBI:82017) has role environmental contaminant (CHEBI:78298)
fluroxypyr (CHEBI:82017) has role herbicide (CHEBI:24527)
fluroxypyr (CHEBI:82017) has role xenobiotic (CHEBI:35703)
fluroxypyr (CHEBI:82017) is a aminopyridine (CHEBI:38207)
fluroxypyr (CHEBI:82017) is a aromatic ether (CHEBI:35618)
fluroxypyr (CHEBI:82017) is a monocarboxylic acid (CHEBI:25384)
fluroxypyr (CHEBI:82017) is a organochlorine compound (CHEBI:36683)
fluroxypyr (CHEBI:82017) is a organofluorine compound (CHEBI:37143)
IUPAC Name
[(4-amino-3,5-dichloro-6-fluoropyridin-2-yl)oxy]acetic acid
Manual Xrefs Databases
347 PPDB
C18858 KEGG COMPOUND
fluroxypyr Alan Wood's Pesticides
Fluroxypyr Wikipedia
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Registry Numbers Types Sources
69377-81-7 CAS Registry Number ChemIDplus
69377-81-7 CAS Registry Number NIST Chemistry WebBook
7136185 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
23128745 PubMed citation Europe PMC
24719846 PubMed citation Europe PMC
25205153 PubMed citation Europe PMC
Last Modified
06 November 2014
General Comment
2014-10-29 Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag