(2-hydroxy-3-methoxyphenyl)(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile
Chemical Structure Depiction of
(2-hydroxy-3-methoxyphenyl)(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile
(2-hydroxy-3-methoxyphenyl)(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile
Compound characteristics
| Compound ID: | 8011-9726 |
| Compound Name: | (2-hydroxy-3-methoxyphenyl)(3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-yl)acetonitrile |
| Molecular Weight: | 273.33 |
| Molecular Formula: | C15 H19 N3 O2 |
| Smiles: | CC1CC(C)(C)N(C(C#N)c2cccc(c2O)OC)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8849 |
| logD: | 2.8837 |
| logSw: | -2.9527 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.763 |
| InChI Key: | QIOPKDPYEYUMOE-GFCCVEGCSA-N |