Reaction Details | |
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Cell Reactant: | BDBM11 |
Syringe Reactant: | BDBM50111977 |
Meas. Tech.: | ITC |
Entry Date: | 12/08/10 |
Δ G ° : | n/a |
pH: | 4.05±0 |
Log10Kb: | 5.48± n/a |
Temperature: | 298.15±0 (K) |
ΔH° : | -7.54±0 (kcal/mole) |
ΔHobs: | n/a |
Ionic Strength: | n/a |
n/a | |
Protons Released: | n/a |
ΔCp : | n/a |
Stoich. Param.: | n/a |
ΔS° : | 0± (kcal/mole-K) |
Comments: | First trial |
Citation | Eftink, MR; Andy, ML; Bystrom, K; Perlmutter, HD; Kristol, DS Cyclodextrin Inclusion Complexes: Studies of the Variation in the Size of Alicyclic Guests J Am Chem Soc111:6765-72 (1989) Article |
More Info.: | Get all data from this article , ITC RUN data , Solution Info , Instrument Info |
BDBM11 | |
Source: | 7585-39-9 |
Purity: | n/a |
Prep. Method: | n/a |
Name | BDBM11 |
Synonyms: | beta-cyclodextrin | betadex |
Type | Molecular Host |
Emp. Form. | C42H70O35 |
Mol. Mass. | 1134.9842 |
SMILES | [H][C@]1(CO)O[C@]2([H])O[C@]3([H])[C@@]([H])(CO)O[C@]([H])(O[C@]4([H])[C@@]([H])(CO)O[C@]([H])(O[C@]5([H])[C@@]([H])(CO)O[C@]([H])(O[C@]6([H])[C@@]([H])(CO)O[C@]([H])(O[C@]7([H])[C@@]([H])(CO)O[C@]([H])(O[C@]8([H])[C@@]([H])(CO)O[C@]([H])(O[C@@]1([H])[C@]([H])(O)[C@@]2([H])O)[C@]([H])(O)[C@@]8([H])O)[C@]([H])(O)[C@@]7([H])O)[C@]([H])(O)[C@@]6([H])O)[C@]([H])(O)[C@@]5([H])O)[C@]([H])(O)[C@@]4([H])O)[C@]([H])(O)[C@@]3([H])O |
Structure | |
BDBM50111977 | |
Source: | n/a |
Purity: | n/a |
Prep. Method: | n/a |
Name | BDBM50111977 |
Synonyms: | 1-adamantanecarboxylate (AC) | Adamantane-1-carboxylic acid | CHEMBL170568 |
Type | Small organic molecule |
Emp. Form. | C11H16O2 |
Mol. Mass. | 180.2435 |
SMILES | [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)C(O)=O |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5| |
Structure |
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