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Details

Stereochemistry ACHIRAL
Molecular Formula C12H6Br4O
Molecular Weight 485.791
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2',4,6'-TETRABROMODIPHENYL ETHER

SMILES

BrC1=CC=C(OC2=C(Br)C=CC=C2Br)C(Br)=C1

InChI

InChIKey=WKBBBTLDLKYGBI-UHFFFAOYSA-N
InChI=1S/C12H6Br4O/c13-7-4-5-11(10(16)6-7)17-12-8(14)2-1-3-9(12)15/h1-6H

HIDE SMILES / InChI

Molecular Formula C12H6Br4O
Molecular Weight 485.791
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Molecular orbital studies on brominated diphenyl ethers. Part I--conformational properties.
2005 May
Substance Class Chemical
Created
by admin
on Sat Dec 16 00:14:37 GMT 2023
Edited
by admin
on Sat Dec 16 00:14:37 GMT 2023
Record UNII
48056F316C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2',4,6'-TETRABROMODIPHENYL ETHER
Common Name English
BENZENE, 1,3-DIBROMO-2-(2,4-DIBROMOPHENOXY)-
Systematic Name English
PBDE 51
Common Name English
Code System Code Type Description
PUBCHEM
21604828
Created by admin on Sat Dec 16 00:14:37 GMT 2023 , Edited by admin on Sat Dec 16 00:14:37 GMT 2023
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CAS
189084-57-9
Created by admin on Sat Dec 16 00:14:37 GMT 2023 , Edited by admin on Sat Dec 16 00:14:37 GMT 2023
PRIMARY
EPA CompTox
DTXSID40616285
Created by admin on Sat Dec 16 00:14:37 GMT 2023 , Edited by admin on Sat Dec 16 00:14:37 GMT 2023
PRIMARY
FDA UNII
48056F316C
Created by admin on Sat Dec 16 00:14:37 GMT 2023 , Edited by admin on Sat Dec 16 00:14:37 GMT 2023
PRIMARY