4-cyanophenol
- CAS:
- Other names:
- SMILES: Oc1ccc(cc1)C#N
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 119.12 | 2 | 1 | 1.26 | 44.019999999999996 | 0 | 26 | 0.00 | C7H5NO |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| JN_53 | 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 |
|---|---|---|---|---|---|---|
| [a-Cyclodextrin](1).[4-cyanophenol] | 2.08 | 1.30 | 3.05 | 25.0 | absorption spectroscopy, NMR | Sanyo Hamai 1997 |
| [b-Cyclodextrin](1).[4-cyanophenol] | 2.52 | 1.48 | 3.05 | 25.0 | absorption spectroscopy, NMR | Sanyo Hamai 1997 |