3-NitroBenzoic acid anion
- CAS:
- Other names:
- SMILES: O=C([O-])C1=CC=CC([N+]([O-])=O)=C1
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 166.11 | 2 | 0 | 0.48 | 85.94999999999999 | 2 | 54 | 0.00 | C7H4NO4- |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| nt0646 | 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).[3-NitroBenzoic acid anion] | 2.69 | 25.0 | Kenneth A. Connors 1995 | |||