nitrobenzene
- CAS:
- Other names:
- SMILES: [O-][N+](=O)c1ccccc1
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 123.11 | 1 | 0 | 2.12 | 45.82 | 1 | 25 | 0.00 | C6H5NO2 |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| JN_101 | 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).[nitrobenzene] | 1.95 | 0.68 | 25.0 | Uv-vis and fluorescence spectroscopy | Qing-Xiang Guo 1998 | |
| [a-Cyclodextrin](1).[nitrobenzene] | 1.69 | 1.00 | Qing-Xiang Guo 1998 | |||