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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H5Br5O
Molecular Weight 564.688
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

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

InChI

InChIKey=RQMSPGJESCCPQX-UHFFFAOYSA-N
InChI=1S/C12H5Br5O/c13-6-2-1-3-8(10(6)15)18-9-5-4-7(14)11(16)12(9)17/h1-5H

HIDE SMILES / InChI

Molecular Formula C12H5Br5O
Molecular Weight 564.688
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 09:34:50 GMT 2023
Edited
by admin
on Sat Dec 16 09:34:50 GMT 2023
Record UNII
4Y4M1GWM2T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2',3,3',4-PENTABROMODIPHENYL ETHER
Common Name English
PBDE 82
Common Name English
BENZENE, 1,2,3-TRIBROMO-4-(2,3-DIBROMOPHENOXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
12073154
Created by admin on Sat Dec 16 09:34:50 GMT 2023 , Edited by admin on Sat Dec 16 09:34:50 GMT 2023
PRIMARY
CAS
327185-11-5
Created by admin on Sat Dec 16 09:34:50 GMT 2023 , Edited by admin on Sat Dec 16 09:34:50 GMT 2023
PRIMARY
FDA UNII
4Y4M1GWM2T
Created by admin on Sat Dec 16 09:34:50 GMT 2023 , Edited by admin on Sat Dec 16 09:34:50 GMT 2023
PRIMARY
EPA CompTox
DTXSID20477018
Created by admin on Sat Dec 16 09:34:50 GMT 2023 , Edited by admin on Sat Dec 16 09:34:50 GMT 2023
PRIMARY