methyl 4-(morpholin-4-yl)-3,5-dinitrobenzoate
Chemical Structure Depiction of
methyl 4-(morpholin-4-yl)-3,5-dinitrobenzoate
methyl 4-(morpholin-4-yl)-3,5-dinitrobenzoate
Compound characteristics
| Compound ID: | 0242-0724 |
| Compound Name: | methyl 4-(morpholin-4-yl)-3,5-dinitrobenzoate |
| Molecular Weight: | 311.25 |
| Molecular Formula: | C12 H13 N3 O7 |
| Smiles: | COC(c1cc(c(c(c1)[N+]([O-])=O)N1CCOCC1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3332 |
| logD: | 2.3332 |
| logSw: | -2.4173 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 98.333 |
| InChI Key: | YLCGOIWLQUQPLK-UHFFFAOYSA-N |