3-Nitrocinnamic acid
- CAS:
- Other names: 3-Nitrocinnamic acid; m-Nitrocinnamic acid; 2-Propenoic acid, 3-(3-nitrophenyl)-; Cinnamic acid, m-nitro; 3-Nitrobenzenepropenoic acid; (2E)-3-(3-Nitrophenyl)-2-propenoic acid
- SMILES: OC(=O)C=Cc1cccc(c1)[N+]([O-])=O
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 193.16 | 3 | 1 | 2.22 | 83.12 | 3 | 61 | 0.00 | C9H7NO4 |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| nt1586 | 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).[3-Nitrocinnamic acid] | 1.76 | 25.0 | Kenneth A. Connors 1995 | |||