(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)propanedinitrile
Chemical Structure Depiction of
(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)propanedinitrile
(3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)propanedinitrile
Compound characteristics
| Compound ID: | 8008-3412 |
| Compound Name: | (3,3-dimethyl-3,4-dihydroisoquinolin-1(2H)-ylidene)propanedinitrile |
| Molecular Weight: | 223.27 |
| Molecular Formula: | C14 H13 N3 |
| Smiles: | CC1(C)Cc2ccccc2C(=C(C#N)C#N)N1 |
| Stereo: | ACHIRAL |
| logP: | 2.4514 |
| logD: | 2.4298 |
| logSw: | -2.8153 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.794 |
| InChI Key: | KXTRQYWNVBFJGJ-UHFFFAOYSA-N |