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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H3Br7O
Molecular Weight 722.48
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,3,3',4,4',5,5'-HEPTABROMODIPHENYL ETHER

SMILES

BrC1=CC(OC2=CC(Br)=C(Br)C(Br)=C2Br)=CC(Br)=C1Br

InChI

InChIKey=CQVLRTUESBMMJW-UHFFFAOYSA-N
InChI=1S/C12H3Br7O/c13-5-1-4(2-6(14)9(5)16)20-8-3-7(15)10(17)12(19)11(8)18/h1-3H

HIDE SMILES / InChI

Molecular Formula C12H3Br7O
Molecular Weight 722.48
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 00:59:04 GMT 2023
Edited
by admin
on Sat Dec 16 00:59:04 GMT 2023
Record UNII
BR29G93229
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,3,3',4,4',5,5'-HEPTABROMODIPHENYL ETHER
Common Name English
PBDE 189
Common Name English
BENZENE, 1,2,3,4-TETRABROMO-5-(3,4,5-TRIBROMOPHENOXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
85769495
Created by admin on Sat Dec 16 00:59:04 GMT 2023 , Edited by admin on Sat Dec 16 00:59:04 GMT 2023
PRIMARY
FDA UNII
BR29G93229
Created by admin on Sat Dec 16 00:59:04 GMT 2023 , Edited by admin on Sat Dec 16 00:59:04 GMT 2023
PRIMARY
CAS
259087-35-9
Created by admin on Sat Dec 16 00:59:04 GMT 2023 , Edited by admin on Sat Dec 16 00:59:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID50879980
Created by admin on Sat Dec 16 00:59:04 GMT 2023 , Edited by admin on Sat Dec 16 00:59:04 GMT 2023
PRIMARY