coumatetralyl
- CAS:
- Other names:
- SMILES: OC1=C(C2CCCc3ccccc23)C(=O)c4ccccc4O1
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 292.33 | 2 | 1 | 3.97 | 50.44 | 1 | 105 | 0.21 | C19H16O3 |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| JN_196 | 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 |
|---|---|---|---|---|---|---|
| [b-Cyclodextrin](1).[coumatetralyl] | 2.75 | 1.62 | 20.0 | fluorescence spectroscopy | Jean-Jacques Aaron 1998 | |
| [b-Cyclodextrin](1).[coumatetralyl] | 2.83 | synchronous fluorescence measurements | Jean-Jacques Aaron 1998 | |||
| [2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[coumatetralyl] | 2.79 | 1.59 | 20.0 | fluorescence spectroscopy | Jean-Jacques Aaron 1998 | |