2-Nitrocinnamic acid
- CAS:
- Other names: 2-Nitrocinnamic acid; o-Nitrocinnamic acid; 2-Propenoic acid, 3-(2-nitrophenyl)-; Cinnamic acid, o-nitro-; (2E)-3-(2-Nitrophenyl)-2-propenoic acid
- SMILES: OC(=O)C=Cc1ccccc1[N+]([O-])=O
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 193.16 | 3 | 1 | 2.22 | 83.12 | 3 | 65 | 0.00 | C9H7NO4 |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| nt0663 | 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).[2-Nitrocinnamic acid] | 2.01 | 25.0 | Kenneth A. Connors 1995 | |||