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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 .BETA.-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-UFVWWTPHSA-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

Molecular Formula C12H18Br6
Molecular Weight 641.695
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:48 GMT 2023
Edited
by admin
on Sat Dec 16 09:17:48 GMT 2023
Record UNII
169IC4T62F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-HEXABROMOCYCLODODECANE
Common Name English
(±)-.BETA.-HBCD
Common Name English
.BETA.-HBCD
MI  
Common Name English
CYCLODODECANE, 1,2,5,6,9,10-HEXABROMO-, (1R,2S,5R,6R,9R,10S)-REL-
Systematic Name English
.BETA.-HBCD [MI]
Common Name English
.BETA.-HEXABROMOCYCLODODECANE, (±)-
Common Name English
Code System Code Type Description
MERCK INDEX
m5982
Created by admin on Sat Dec 16 09:17:48 GMT 2023 , Edited by admin on Sat Dec 16 09:17:48 GMT 2023
PRIMARY Merck Index
PUBCHEM
13040187
Created by admin on Sat Dec 16 09:17:48 GMT 2023 , Edited by admin on Sat Dec 16 09:17:48 GMT 2023
PRIMARY
FDA UNII
169IC4T62F
Created by admin on Sat Dec 16 09:17:48 GMT 2023 , Edited by admin on Sat Dec 16 09:17:48 GMT 2023
PRIMARY
CAS
134237-51-7
Created by admin on Sat Dec 16 09:17:48 GMT 2023 , Edited by admin on Sat Dec 16 09:17:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID60873772
Created by admin on Sat Dec 16 09:17:48 GMT 2023 , Edited by admin on Sat Dec 16 09:17:48 GMT 2023
PRIMARY