methyl 5-methyl-2,4-dinitrobenzoate
Chemical Structure Depiction of
methyl 5-methyl-2,4-dinitrobenzoate
methyl 5-methyl-2,4-dinitrobenzoate
Compound characteristics
Compound ID: | 8005-9036 |
Compound Name: | methyl 5-methyl-2,4-dinitrobenzoate |
Molecular Weight: | 240.17 |
Molecular Formula: | C9 H8 N2 O6 |
Smiles: | Cc1cc(C(=O)OC)c(cc1[N+]([O-])=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.1884 |
logD: | 2.1884 |
logSw: | -2.3379 |
Hydrogen bond acceptors count: | 11 |
Polar surface area: | 87.574 |
InChI Key: | ODNYLVYXOHNFOS-UHFFFAOYSA-N |