1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one
Chemical Structure Depiction of
1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one
1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one
Compound characteristics
| Compound ID: | 8015-8393 |
| Compound Name: | 1-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one |
| Molecular Weight: | 322.28 |
| Molecular Formula: | C12 H14 N6 O5 |
| Smiles: | Cc1c(c(C)n(C(CCCn2cc(cn2)[N+]([O-])=O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.0153 |
| logD: | -0.0153 |
| logSw: | -0.4224 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 108.242 |
| InChI Key: | GFGXYKNMPXKYQS-UHFFFAOYSA-N |