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CHEBI:28298 - 2,2',4,4',5-pentachlorodiphenyl ether

Default Structure
ChEBI IDCHEBI:28298
ChEBI Name2,2',4,4',5-pentachlorodiphenyl ether
Stars
Secondary ChEBI IDsCHEBI:854, CHEBI:19278
Last Modified24 October 2014
DownloadsMolfile
FormulaC12H5Cl5O
Net Charge0
Average Mass342.436
Monoisotopic Mass339.87830
SMILESClc1ccc(Oc2cc(Cl)c(Cl)cc2Cl)c(Cl)c1
InChIInChI=1S/C12H5Cl5O/c13-6-1-2-11(9(16)3-6)18-12-5-8(15)7(14)4-10(12)17/h1-5H
InChIKeyAVURWLKSFZBANQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,2',4,4',5-pentachlorodiphenyl ether (CHEBI:28298) is a aromatic ether (CHEBI:35618)
2,2',4,4',5-pentachlorodiphenyl ether (CHEBI:28298) is a dichlorobenzene (CHEBI:23697)
2,2',4,4',5-pentachlorodiphenyl ether (CHEBI:28298) is a trichlorobenzene (CHEBI:27096)
Synonyms  Source
2,2',4,4',5-pentachlorodiphenyl etherChEBI
2,2',4,4',5-Pentachlorodiphenyl etherKEGG COMPOUND
Manual XrefsDatabases
C11044KEGG COMPOUND
C11044KEGG COMPOUND
Registry NumbersSources
CAS:60123-64-0KEGG COMPOUND