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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H4Br4Cl2
Molecular Weight 490.639
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,4,5-TETRABROMO-3,6-BIS(CHLOROMETHYL)BENZENE

SMILES

ClCC1=C(Br)C(Br)=C(CCl)C(Br)=C1Br

InChI

InChIKey=ILZQVEFCITYZFF-UHFFFAOYSA-N
InChI=1S/C8H4Br4Cl2/c9-5-3(1-13)6(10)8(12)4(2-14)7(5)11/h1-2H2

HIDE SMILES / InChI

Molecular Formula C8H4Br4Cl2
Molecular Weight 490.639
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 Tue Apr 01 19:12:50 GMT 2025
Edited
by admin
on Tue Apr 01 19:12:50 GMT 2025
Record UNII
X5P8J2T79T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,4,5-TETRABROMO-3,6-BIS(CHLOROMETHYL)BENZENE
Systematic Name English
2,3,5,6-TETRABROMO-.ALPHA.,.ALPHA.'-DICHLORO-P-XYLENE
Preferred Name English
BENZENE, 1,2,4,5-TETRABROMO-3,6-BIS(CHLOROMETHYL)-
Systematic Name English
Code System Code Type Description
CAS
39568-98-4
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID30192684
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
ECHA (EC/EINECS)
254-519-4
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
PUBCHEM
3016089
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY
FDA UNII
X5P8J2T79T
Created by admin on Tue Apr 01 19:12:50 GMT 2025 , Edited by admin on Tue Apr 01 19:12:50 GMT 2025
PRIMARY