β-HBCD

CAS Registry Number®

134237-51-7
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CAS Name

β-HBCD

Molecular Formula

C12H18Br6

Molecular Mass

641.70

Cite this Page

β-HBCD.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=134237-51-7 (retrieved 2024-04-19) (CAS RN: 134237-51-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

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-FOUKJZKRNA-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,2S,5R,6R,9R,10S)-rel-
  • Cyclododecane, 1,2,5,6,9,10-hexabromo-, (1R*,2R*,5R*,6S*,9R*,10S*)-
  • rel-(1R,2S,5R,6R,9R,10S)-1,2,5,6,9,10-Hexabromocyclododecane
  • β-HBCD
  • β-Hexabromocyclododecane

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