CHEBI:81584 - 2,2',4,4'-Tetrabromodiphenyl ether

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2,2',4,4'-Tetrabromodiphenyl ether
ChEBI ID CHEBI:81584
Stars This entity has been manually annotated by a third party.
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C12H6Br4O
Net Charge 0
Average Mass 485.79100
Monoisotopic Mass 481.71522
InChI InChI=1S/C12H6Br4O/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6H
InChIKey XYBSIYMGXVUVGY-UHFFFAOYSA-N
SMILES Brc1ccc(Oc2ccc(Br)cc2Br)c(Br)c1
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood (UBERON:0000178). See: Report on Human Biomonitoring of Environmental Chemicals in Canada (2010). ISBN 978-1-100-15618-7. Cat no. H128-1/10-601E
ChEBI Ontology
Outgoing 2,2',4,4'-Tetrabromodiphenyl ether (CHEBI:81584) is a aromatic ether (CHEBI:35618)
2,2',4,4'-Tetrabromodiphenyl ether (CHEBI:81584) is a organobromine compound (CHEBI:37141)
Synonyms Sources
1,1'-Oxybis(2,4-dibromo-Benzene HMDB
1,1'-Oxybis(2,4-dibromobenzene) HMDB
1,1'-Oxybis[2,4-dibromobenzene], 9CI HMDB
2,2',4,4'-TetraBDE HMDB
2,2',4,4'-Tetrabromodiphenyl ether HMDB
2,2'4,4'-Tetrabromodiphenyl ether HMDB
2,4-dibromo-1-(2,4-dibromophenoxy)benzene HMDB
BDE 47 KEGG COMPOUND
Dibromophenyl ether HMDB
PBDE 47 KEGG COMPOUND
PBDE-47 HMDB
Manual Xrefs Databases
C18205 KEGG COMPOUND
HMDB0037547 HMDB
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Registry Number Type Source
5436-43-1 CAS Registry Number KEGG COMPOUND
Citations Waiting for Citations
Last Modified
23 October 2015