CAS Registry Number®
134237-50-6
CAS Name
α-Hexabromocyclododecane
Molecular Formula
C12H18Br6
Molecular Mass
641.69
Compound Properties
-
Melting Point (1)
179-181 °C
Source(s)
- (1) Smith, Keith; Organic & Biomolecular Chemistry, (2005), 3(10), 1880-1892, CAplus
Other Names and Identifiers
InChI
InChI=1/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-/s2
InChIKey
InChIKey=DEIGXXQKDWULML-WETDGMMTNA-N
SMILES
Br[C@H]1[C@H](Br)CC[C@H](Br)[C@H](Br)CC[C@@H](Br)[C@@H](Br)CC1
Canonical SMILES
BrC1CCC(Br)C(Br)CCC(Br)C(Br)CCC1Br
Other Names for this Substance
- Cyclododecane, 1,2,5,6,9,10-hexabromo-, (1R,2R,5S,6R,9R,10S)-rel–
- Cyclododecane, 1,2,5,6,9,10-hexabromo-, (1R*,2R*,5S*,6R*,9R*,10S*)-
- rel-(1R,2R,5S,6R,9R,10S)-1,2,5,6,9,10-Hexabromocyclododecane
- α-HBCD
- α-Hexabromocyclododecane
