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CHEBI:17192 - 3,5-dibromo-4-hydroxybenzonitrile

ChEBI IDCHEBI:17192
ChEBI Name3,5-dibromo-4-hydroxybenzonitrile
Stars
DefinitionA dibromobenzene that is 2,6-dibromophenol substituted by a cyano group at position 4.
Secondary ChEBI IDsCHEBI:1396, CHEBI:11706, CHEBI:19898
Last Modified3 November 2014
DownloadsMolfile
FormulaC7H3Br2NO
Net Charge0
Average Mass276.915
Monoisotopic Mass274.85814
SMILESN#Cc1cc(Br)c(O)c(Br)c1
InChIInChI=1S/C7H3Br2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H
InChIKeyUPMXNNIRAGDFEH-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role:
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:
herbicide  A substance used to destroy plant pests.
ChEBI Ontology
Outgoing Relation(s)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) has functional parent 2,6-dibromophenol (CHEBI:19391)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) has role environmental contaminant (CHEBI:78298)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) has role herbicide (CHEBI:24527)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) has role xenobiotic (CHEBI:35703)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) is a dibromobenzene (CHEBI:37147)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) is a hydroxynitrile (CHEBI:24730)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) is a phenols (CHEBI:33853)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) is conjugate acid of 3,5-dibromo-4-oxidobenzonitrile(1−) (CHEBI:58046)
Incoming Relation(s)
3,5-dibromo-4-oxidobenzonitrile(1−) (CHEBI:58046) is conjugate base of 3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192)
IUPAC Name 
3,5-dibromo-4-hydroxybenzonitrile
Synonyms  Source
3,5-Dibromo-4-hydroxybenzonitrileKEGG COMPOUND
2,6-dibromo-4-cyanophenolNIST Chemistry WebBook
bromoxynilChemIDplus
3,5-Dibromo-4-hydroxybenzonitrileKEGG COMPOUND
Manual XrefsDatabases
C04178KEGG COMPOUND
c0480UM-BBD
BromoxynilWikipedia
bromoxynilAlan Wood's Pesticides
96PPDB
Registry NumbersSources
Beilstein:2364039Beilstein
Gmelin:1473439Gmelin
CAS:1689-84-5KEGG COMPOUND
CAS:1689-84-5NIST Chemistry WebBook
CAS:1689-84-5ChemIDplus
Citations