2-acetamido-3-(3-nitrophenyl)prop-2-enoic acid
Chemical Structure Depiction of
2-acetamido-3-(3-nitrophenyl)prop-2-enoic acid
2-acetamido-3-(3-nitrophenyl)prop-2-enoic acid
Compound characteristics
| Compound ID: | 0922-0116 |
| Compound Name: | 2-acetamido-3-(3-nitrophenyl)prop-2-enoic acid |
| Molecular Weight: | 250.21 |
| Molecular Formula: | C11 H10 N2 O5 |
| Smiles: | CC(NC(=C\c1cccc(c1)[N+]([O-])=O)\C(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.734 |
| logD: | -1.9776 |
| logSw: | -2.0591 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.123 |
| InChI Key: | PABMJKZMUOMZOR-UHFFFAOYSA-N |