| Phytochemical Name : 3-(4-Hydroxyphenyl)propionitrile |
| PCNDIDOT0687 |
| Pubchem CID : 87079 |
| Molecular formula: C9H9NO |
| Canonical SMILES : C1=CC(=CC=C1CCC#N)O |
Synonymes : 3-(4-Hydroxyphenyl)propionitrile|17362-17-3|3-(4-Hydroxyphenyl)propanenitrile|Benzenepropanenitrile, 4-hydroxy-|3-(p-Hydroxyphenyl)propiononitrile|4-hydroxyhydrocinnamonitrile|3-(4-hydroxyphenyl) propionitrile|EINECS 241-393-0|.beta.-(4-Hydroxyphenyl)propionitrile|NSC163340|p-Oxybenzylacetonitril|p-(2-Cyanoethyl)phenol|4-hydroxyphenylpropionitrile|SCHEMBL450038|DTXSID60938411|3-(4-hydroxyphenyl)proprionitrile|3-(p-hydroxyphenyl) propionitrile|3-(4-hydroxy-phenyl)-propionitrile|3-(4-Hydroxyphenyl)propanenitrile #|MFCD00016492|AKOS005199124|NSC 163340|NSC-163340|TS-01922|FT-0613677|FT-0613678|EN300-1853112|A811540 |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.390 |
| Log Po/w (XLOGP3) : 1.730 |
| Log Po/w (WLOGP) : 1.850 |
| Log Po/w (MLOGP) : 1.440 |
| Log Po/w (SILICOS-IT) : 1.980 |
| Consensus Log Po/w : 1.680 |