CHEBI:30263 - terbutylazine

ChEBI IDCHEBI:30263
ChEBI Nameterbutylazine
Stars
DefinitionA diamino-1,3,5-triazine that is N-tert-butyl-N'-methyl-1,3,5-triazine-2,4-diamine substituted by a chloro group at position 6.
Last Modified4 November 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC9H16ClN5
Net Charge0
Average Mass229.715
Monoisotopic Mass229.10942
SMILESCCNc1nc(Cl)nc(NC(C)(C)C)n1
InChIInChI=1S/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)
InChIKeyFZXISNSWEXTPMF-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Roles:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
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)
terbutylazine (CHEBI:30263) has functional parent 6-chloro-1,3,5-triazine-2,4-diamine (CHEBI:27726)
terbutylazine (CHEBI:30263) has role environmental contaminant (CHEBI:78298)
terbutylazine (CHEBI:30263) has role herbicide (CHEBI:24527)
terbutylazine (CHEBI:30263) has role xenobiotic (CHEBI:35703)
terbutylazine (CHEBI:30263) is a chloro-1,3,5-triazine (CHEBI:38168)
terbutylazine (CHEBI:30263) is a diamino-1,3,5-triazine (CHEBI:38170)
IUPAC Name 
N-(tert-butyl)-6-chloro-N'-ethyl-1,3,5-triazine-2,4-diamine
Synonyms  Source
TerbutylazineChemIDplus
TerbuthylazineNIST Chemistry WebBook
TerbutylethylazineChemIDplus
Manual XrefsDatabases
C18810KEGG COMPOUND
TerbuthylazineWikipedia
terbuthylazineAlan Wood's Pesticides
623PPDB
Registry NumbersSources
Reaxys:3951137Reaxys
CAS:5915-41-3ChemIDplus
CAS:5915-41-3NIST Chemistry WebBook
CAS:5915-41-3KEGG COMPOUND
Citations