N-(1-methoxypropan-2-yl)-3-methyl-2-nitrobenzamide
Chemical Structure Depiction of
N-(1-methoxypropan-2-yl)-3-methyl-2-nitrobenzamide
N-(1-methoxypropan-2-yl)-3-methyl-2-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-3249 |
| Compound Name: | N-(1-methoxypropan-2-yl)-3-methyl-2-nitrobenzamide |
| Molecular Weight: | 252.27 |
| Molecular Formula: | C12 H16 N2 O4 |
| Smiles: | CC(COC)NC(c1cccc(C)c1[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.949 |
| logD: | 1.9486 |
| logSw: | -2.5818 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.568 |
| InChI Key: | SINSNMLSKXKHFE-VIFPVBQESA-N |