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

Details

Stereochemistry RACEMIC
Molecular Formula C12H18Br6
Molecular Weight 641.695
Optical Activity ( + / - )
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-HEXABROMOCYCLODODECANE

SMILES

Br[C@H]1CC[C@@H](Br)[C@H](Br)CC[C@H](Br)[C@H](Br)CC[C@H]1Br

InChI

InChIKey=DEIGXXQKDWULML-PQTSNVLCSA-N
InChI=1S/C12H18Br6/c13-7-1-2-8(14)10(16)5-6-12(18)11(17)4-3-9(7)15/h7-12H,1-6H2/t7-,8-,9+,10+,11-,12-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
.ALPHA.-HEXABROMOCYCLODODECANE
Common Name English
.ALPHA.-HEXABROMOCYCLODODECANE, (±)-
Common Name English
.ALPHA.-HBCD
MI  
Common Name English
.ALPHA.-HBCD [MI]
Common Name English
CYCLODODECANE, 1,2,5,6,9,10-HEXABROMO-, (1R,2R,5S,6R,9R,10S)-REL-
Systematic Name English
(±)-.ALPHA.-HBCD
Common Name English
Code System Code Type Description
PUBCHEM
11763618
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY
MERCK INDEX
m5982
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY Merck Index
CAS
134237-50-6
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY
FDA UNII
A9X5ZAC15C
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY
EPA CompTox
DTXSID00873771
Created by admin on Sat Dec 16 09:17:47 GMT 2023 , Edited by admin on Sat Dec 16 09:17:47 GMT 2023
PRIMARY