Reaction Details  Report a problem with these data
Cell Reactant:
BDBM11
Syringe Reactant:
BDBM50060533
Meas. Tech.:
ITC
Entry Date.:
2010-12-08
ΔG°:
-4.64±0.02 (kcal/mole)
Log10Kb:
2
Temperature:
308.2000±0.0000 (K)
ΔH° :
-2.32±0.02 (kJ/mole)
ΔS° :
0.01±0 (kJ/mole-K)
Comments:
First trial
Citation
 Nilsson, M; Valente, AJ; Olofsson, G; Söderman, O; Bonini, M Thermodynamic and kinetic characterization of host-guest association between bolaform surfactants and alpha- and beta-cyclodextrins. J Phys Chem B 112:11310-6 (2008) [PubMed]  Article
Cell React
Name:
BDBM11
Synonyms:
betadex | beta-cyclodextrin
Type:
Molecular Host
Emp. Form.:
C42H70O35
Mol. Mass.:
1134.37
SMILES:
OC[C@H]1O[C@@H]2O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@H](O[C@@H]5[C@@H](CO)O[C@H](O[C@@H]6[C@@H](CO)O[C@H](O[C@@H]7[C@@H](CO)O[C@H](O[C@@H]8[C@@H](CO)O[C@H](O[C@H]1[C@H](O)[C@H]2O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O
Structure:
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Syringe React
Name:
BDBM50060533
Synonyms:
N1,N1,N1,N12,N12,N12-hexamethyldodecane-1,12-diaminium bromide | CHEMBL119701 | dodecane-1,12-bis(trimethylammonium bromide) | 1,12-bis-(trimethyl ammonium) dodecane dibromide | Dodecamethonium | N,N,N,N',N',N'-Hexamethyl-1,12-dodecane diaminium dibromide | N,N,N,N',N',N'-Hexamethyldodecane-1,12-diammoniumdibromide | 1,12-Bis(trimethyl ammonium)dodecane dibromide
Type:
Small organic molecule
Emp. Form.:
n/a
Mol. Mass.:
n/a
SMILES:
C[N+](C)(C)CCCCCCCCCCCC[N+](C)(C)C
Structure:
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