CHEBI:81929 - MCPA-thioethyl

ChEBI IDCHEBI:81929
ChEBI NameMCPA-thioethyl
Stars
Last Modified18 November 2019
DownloadsMolfile
FormulaC11H13ClO2S
Net Charge0
Average Mass244.743
Monoisotopic Mass244.03248
SMILESCCSC(=O)COc1ccc(Cl)cc1C
InChIInChI=1S/C11H13ClO2S/c1-3-15-11(13)7-14-10-5-4-9(12)6-8(10)2/h4-6H,3,7H2,1-2H3
InChIKeyAZFKQCNGMSSWDS-UHFFFAOYSA-N
Roles Classification
Application:
phenoxy herbicide  Any member of the class of herbicides whose members contain a phenoxy or substituted phenoxy group.
ChEBI Ontology
Outgoing Relation(s)
MCPA-thioethyl (CHEBI:81929) has role phenoxy herbicide (CHEBI:60575)
MCPA-thioethyl (CHEBI:81929) is a aromatic ether (CHEBI:35618)
Manual XrefsDatabases
C18741KEGG COMPOUND
1124PPDB
Registry NumbersSources
CAS:25319-90-8KEGG COMPOUND