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Details

Stereochemistry ACHIRAL
Molecular Formula C12H5Br5
Molecular Weight 548.688
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2',4,5,5'-PENTABROMOBIPHENYL

SMILES

BrC1=CC=C(Br)C(=C1)C2=CC(Br)=C(Br)C=C2Br

InChI

InChIKey=OELBLPCWLAWABI-UHFFFAOYSA-N
InChI=1S/C12H5Br5/c13-6-1-2-9(14)7(3-6)8-4-11(16)12(17)5-10(8)15/h1-5H

HIDE SMILES / InChI

Molecular Formula C12H5Br5
Molecular Weight 548.688
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Characterization of the photolysis of 2,4,5,2',4',5'-hexabromobiphenyl.
1985-06
Differential tissue distribution of various polybrominated biphenyls of Firemaster FF-1 in male rats.
1980-09-01
Studies on the microsomal metabolism and binding of polybrominated biphenyls (PBBs).
1978-04
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:35:32 GMT 2025
Edited
by admin
on Mon Mar 31 22:35:32 GMT 2025
Record UNII
03SL1NG15Q
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PBB 101
Preferred Name English
2,2',4,5,5'-PENTABROMOBIPHENYL
Systematic Name English
1,1'-BIPHENYL, 2,2',4,5,5'-PENTABROMO-
Systematic Name English
Code System Code Type Description
CAS
67888-96-4
Created by admin on Mon Mar 31 22:35:32 GMT 2025 , Edited by admin on Mon Mar 31 22:35:32 GMT 2025
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PUBCHEM
49996
Created by admin on Mon Mar 31 22:35:32 GMT 2025 , Edited by admin on Mon Mar 31 22:35:32 GMT 2025
PRIMARY
FDA UNII
03SL1NG15Q
Created by admin on Mon Mar 31 22:35:32 GMT 2025 , Edited by admin on Mon Mar 31 22:35:32 GMT 2025
PRIMARY
EPA CompTox
DTXSID50218113
Created by admin on Mon Mar 31 22:35:32 GMT 2025 , Edited by admin on Mon Mar 31 22:35:32 GMT 2025
PRIMARY