4-(4-methoxyphenyl)-3-methyl-4-oxobutane-1,1,2,2-tetracarbonitrile
Chemical Structure Depiction of
4-(4-methoxyphenyl)-3-methyl-4-oxobutane-1,1,2,2-tetracarbonitrile
4-(4-methoxyphenyl)-3-methyl-4-oxobutane-1,1,2,2-tetracarbonitrile
Compound characteristics
| Compound ID: | 8020-2641 |
| Compound Name: | 4-(4-methoxyphenyl)-3-methyl-4-oxobutane-1,1,2,2-tetracarbonitrile |
| Molecular Weight: | 292.29 |
| Molecular Formula: | C16 H12 N4 O2 |
| Smiles: | CC(C(c1ccc(cc1)OC)=O)C(C#N)(C#N)C(C#N)C#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7044 |
| logD: | -2.5919 |
| logSw: | -1.9194 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 89.746 |
| InChI Key: | JIFMVTNJZRJXNB-LLVKDONJSA-N |