Reaction Details  Report a problem with these data
Cell Reactant:
BDBM36127
Syringe Reactant:
BDBM36092
Meas. Tech.:
ITC
Entry Date.:
10/15/10
ΔG°:
-3.51±0.01 (kcal/mole)
pH:
6.9±0
Log10Kb:
0.8
Temperature:
298.15±0 (K)
ΔH° :
-3.88±0.05 (kJ/mole)
ΔS° :
-0±0 (kJ/mole-K)
Comments:
First trial
Citation
 Rekharsky, MV; Inoue, Y Complexation and chiral recognition thermodynamics of 6-amino-6-deoxy-beta-cyclodextrin with anionic, cationic, and neutral chiral guests: counterbalance between van der Waals and coulombic interactions. J Am Chem Soc 124:813-26 (2002) [PubMed]  Article
Cell React
Name:
BDBM36127
Synonyms:
6-Amino-6-deoxy-beta-cyclodextrin (am-beta-CD) | 6-NH2-beta-cyclodextrin | mono(6-amino-6-deoxy)-beta-cyclodextrin
Type:
Molecular Host
Emp. Form.:
C42H72NO34
Mol. Mass.:
1135.0068
SMILES:
[NH3+]C[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
Source:
17257-71-5
Name:
BDBM36092
Synonyms:
(S)-alpha-methoxy-alpha-trifluoromethyl phenylacetic acid
Type:
Guest
Emp. Form.:
C10H8F3O3
Mol. Mass.:
233.1645
SMILES:
CO[C@](C([O-])=O)(c1ccccc1)C(F)(F)F
Structure:
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