methyl 4-chloro-3,5-dinitrobenzoate
Chemical Structure Depiction of
methyl 4-chloro-3,5-dinitrobenzoate
methyl 4-chloro-3,5-dinitrobenzoate
Compound characteristics
| Compound ID: | 0914-0014 |
| Compound Name: | methyl 4-chloro-3,5-dinitrobenzoate |
| Molecular Weight: | 260.59 |
| Molecular Formula: | C8 H5 Cl N2 O6 |
| Smiles: | COC(c1cc(c(c(c1)[N+]([O-])=O)[Cl])[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.035 |
| logD: | 2.035 |
| logSw: | -3.0434 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.574 |
| InChI Key: | YJUFTUQWRBJBJN-UHFFFAOYSA-N |