[(8-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]propanedinitrile
Chemical Structure Depiction of
[(8-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]propanedinitrile
[(8-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]propanedinitrile
Compound characteristics
| Compound ID: | 8020-6483 |
| Compound Name: | [(8-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]propanedinitrile |
| Molecular Weight: | 257.2 |
| Molecular Formula: | C12 H7 N3 O4 |
| Smiles: | C1COc2c(cc(C=C(C#N)C#N)cc2O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.4151 |
| logD: | 1.4151 |
| logSw: | -1.8136 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 82.939 |
| InChI Key: | MMGMJTQWZJEAPY-UHFFFAOYSA-N |