5-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole
Chemical Structure Depiction of
5-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole
5-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole
Compound characteristics
| Compound ID: | 0364-0067 |
| Compound Name: | 5-(2-nitroprop-1-en-1-yl)-2H-1,3-benzodioxole |
| Molecular Weight: | 207.18 |
| Molecular Formula: | C10 H9 N O4 |
| Smiles: | C/C(=C\c1ccc2c(c1)OCO2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3675 |
| logD: | 2.3675 |
| logSw: | -2.6109 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.992 |
| InChI Key: | CCEVJKZHAJJQJR-QPJJXVBHSA-N |