tert-butyl 2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazine-1-carboxylate
tert-butyl 2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazine-1-carboxylate
Compound characteristics
| Compound ID: | 4328-0096 |
| Compound Name: | tert-butyl 2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazine-1-carboxylate |
| Molecular Weight: | 309.28 |
| Molecular Formula: | C13 H15 N3 O6 |
| Smiles: | CC(C)(C)OC(N/N=C\c1cc2c(cc1[N+]([O-])=O)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3914 |
| logD: | 3.3899 |
| logSw: | -3.9748 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.212 |
| InChI Key: | KKQSNTOYBYYXAZ-UHFFFAOYSA-N |