1.0 2026-09-22 18:52:42 UTC 2026-09-22 18:52:42 UTC FDB118715 alpha-Hexabromocyclododecane (+-)-ALPHA-HBCD (1R,2R,5S,6R,9R,10S)-1,2,5,6,9,10-hexabromocyclododecane C12H18Br6 641.7 635.650879 (1R,2R,5S,6R,9R,10S)-1,2,5,6,9,10-hexabromocyclododecane (1R,2R,5S,6R,9R,10S)-1,2,5,6,9,10-hexabromocyclododecane Br[C@H]1CC[C@@H](Br)[C@H](Br)CC[C@H](Br)[C@H](Br)CC[C@H]1Br 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 DEIGXXQKDWULML-PQTSNVLCSA-N belongs to the class of organic compounds known as organobromides. Organobromides are compounds containing a chemical bond between a carbon atom and a bromine atom. Organobromides Organic compounds Organohalogen compounds Organobromides Aliphatic homomonocyclic compounds Alkyl bromides Hydrocarbon derivatives Aliphatic homomonocyclic compound Alkyl bromide Alkyl halide Hydrocarbon derivative Organobromide logp 6.45 ALOGPS logs -6.96 ALOGPS solubility 7.07e-05 g/l ALOGPS logp 7.19 ChemAxon iupac (1R,2R,5S,6R,9R,10S)-1,2,5,6,9,10-hexabromocyclododecane ChemAxon average_mass 641.7 ChemAxon mono_mass 635.650879 ChemAxon smiles Br[C@H]1CC[C@@H](Br)[C@H](Br)CC[C@H](Br)[C@H](Br)CC[C@H]1Br ChemAxon formula C12H18Br6 ChemAxon inchi 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 ChemAxon inchikey DEIGXXQKDWULML-PQTSNVLCSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 100.51 ChemAxon polarizability 41.22 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 1302754 Specdb::MsMs 1302755 Specdb::MsMs 1302756 Specdb::MsMs 1417330 Specdb::MsMs 1417331 Specdb::MsMs 1417332