potassium--1,1,3,3-tetracyano-2-[2-(methoxycarbonyl)benzoyl]prop-2-en-1-ide (1/1)
Chemical Structure Depiction of
potassium--1,1,3,3-tetracyano-2-[2-(methoxycarbonyl)benzoyl]prop-2-en-1-ide (1/1)
potassium--1,1,3,3-tetracyano-2-[2-(methoxycarbonyl)benzoyl]prop-2-en-1-ide (1/1)
Compound characteristics
| Compound ID: | 8020-7812 |
| Compound Name: | potassium--1,1,3,3-tetracyano-2-[2-(methoxycarbonyl)benzoyl]prop-2-en-1-ide (1/1) |
| Molecular Weight: | 342.35 |
| Molecular Formula: | C16 H7 N4 O3 |
| Salt: | K+ |
| Smiles: | COC(c1ccccc1C(C([C-](C#N)C#N)=C(C#N)C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9896 |
| logD: | 0.9896 |
| logSw: | -2.2028 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 103.376 |
| InChI Key: | JCQZAUNZCXWWKL-UHFFFAOYSA-N |