(S)-a-methoxy-a-trifluoromethylphenylacetic acid
- CAS:
- Other names:
- SMILES: O=C(O)[C@@](OC)(C1=CC=CC=C1)C(F)(F)F
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 234.17 |
3 |
1 |
2.18 |
46.53 |
4 |
52 |
0.30 |
C10H9F3O3 |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
SF_C1559 |
None |
|
Jan. 1, 2023 |
Bar codes
| Plate barcode |
Sample barcode |
|
|
PAINS
| Identified PAINS |
| Not checked |
Supramolecules
| Name | log K | SD | pH | T(°C) | Method | Ref |
| [mono-(6-amino-6-deoxy)-b-CD](1).[(S)-a-methoxy-a-trifluoromethylphenylacetic acid ] |
2.57 |
0.78 |
6.9 |
25.0 |
Titration Calorimetry |
Yoshihisa Inoue 2002 |
| [b-Cyclodextrin](1).[(S)-a-methoxy-a-trifluoromethylphenylacetic acid ] |
2.15 |
0.30 |
6.9 |
25.0 |
Titration Calorimetry |
Yoshihisa Inoue 2002 |