methyl 5-bromo-2,4-dinitrobenzoate
Chemical Structure Depiction of
methyl 5-bromo-2,4-dinitrobenzoate
methyl 5-bromo-2,4-dinitrobenzoate
Compound characteristics
| Compound ID: | 8005-9037 |
| Compound Name: | methyl 5-bromo-2,4-dinitrobenzoate |
| Molecular Weight: | 305.04 |
| Molecular Formula: | C8 H5 Br N2 O6 |
| Smiles: | COC(c1cc(c(cc1[N+]([O-])=O)[N+]([O-])=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3365 |
| logD: | 2.3365 |
| logSw: | -2.4549 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.574 |
| InChI Key: | NUWLCELKKKVQMM-UHFFFAOYSA-N |