methyl 4-[(2-methoxy-2-oxoethyl)amino]-3-nitrobenzoate
Chemical Structure Depiction of
methyl 4-[(2-methoxy-2-oxoethyl)amino]-3-nitrobenzoate
methyl 4-[(2-methoxy-2-oxoethyl)amino]-3-nitrobenzoate
Compound characteristics
| Compound ID: | 8016-5550 |
| Compound Name: | methyl 4-[(2-methoxy-2-oxoethyl)amino]-3-nitrobenzoate |
| Molecular Weight: | 268.22 |
| Molecular Formula: | C11 H12 N2 O6 |
| Smiles: | COC(CNc1ccc(cc1[N+]([O-])=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6529 |
| logD: | 1.6529 |
| logSw: | -2.2438 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.88 |
| InChI Key: | WABUYJXRDJWTKO-UHFFFAOYSA-N |