U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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 3,3',4,5-TETRABROMODIPHENYL ETHER

SMILES

BrC1=CC(OC2=CC(Br)=C(Br)C(Br)=C2)=CC=C1

InChI

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

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:34:49 GMT 2023
Edited
by admin
on Sat Dec 16 09:34:49 GMT 2023
Record UNII
OA2XU37VTP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3',4,5-TETRABROMODIPHENYL ETHER
Common Name English
PBDE 78
Common Name English
BENZENE, 1,2,3-TRIBROMO-5-(3-BROMOPHENOXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
86208517
Created by admin on Sat Dec 16 09:34:49 GMT 2023 , Edited by admin on Sat Dec 16 09:34:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID80879897
Created by admin on Sat Dec 16 09:34:49 GMT 2023 , Edited by admin on Sat Dec 16 09:34:49 GMT 2023
PRIMARY
CAS
446254-45-1
Created by admin on Sat Dec 16 09:34:49 GMT 2023 , Edited by admin on Sat Dec 16 09:34:49 GMT 2023
PRIMARY
FDA UNII
OA2XU37VTP
Created by admin on Sat Dec 16 09:34:49 GMT 2023 , Edited by admin on Sat Dec 16 09:34:49 GMT 2023
PRIMARY