| Phytochemical Name : 2-Phenyl-2-butenal |
| PCNDIDOT0661 |
| Pubchem CID : 6429333 |
| Molecular formula: C10H10O |
| Canonical SMILES : CC=C(C=O)C1=CC=CC=C1 |
Synonymes : 2-PHENYL-2-BUTENAL|2-Phenylbutenal|2-Phenylcrotonaldehyde|4411-89-6|(E)-2-phenylbut-2-enal|alpha-Phenylcrotonaldehyde|(E)-2-Phenylcrotonaldehyde|2-Phenyl-2-butenal, (2E)-|2-Butenal, 2-phenyl|alpha-Ethylidenebenzeneacetaldehyde|FEMA No. 3224, E-|UNII-N8EMO6YRV9|N8EMO6YRV9|Crotonaldehyde, 2-phenyl-|UNII-E8991Q8HSC|FEMA No. 3224|EINECS 224-567-0|Benzeneacetaldehyde, alpha-ethylidene-|55088-52-3|Benzeneacetaldehyde, alpha-ethylidene-, (E)-|54075-09-1|Benzeneacetaldehyde, alpha-ethylidene-, (alphaE)-|2-Phenyl-2-buten-1-al|Benzeneacetaldehyde, ?-ethylidene-|Phenylcrotonaldehyd|Benzeneacetaldehyde, .alpha.-ethylidene-|2-Phenyl-2-butenal, (E)+(Z)|2-Phenyl-Crotonaldehyde|(E)-2-phenyl-2-butenal|(2e)-2-phenyl-2-butenal|(2E)-2-phenylbut-2-enal|SCHEMBL950633|a-Ethylidene-Benzeneacetaldehyde|E8991Q8HSC|Bencenacetaldehido, ?-etilideno-|CHEBI:89904|FEMA 3224|2-Phenyl-2-butenal,(E)+(Z)|alpha -ethylidenbenzeneacetaldehyde|alpha-Ethylidene-Benzeneacetaldehyde|alpha -ethylidene-phenylacetaldehyde|a-Ethylidenebenzeneacetaldehyde, 9CI|EINECS 259-476-5|MFCD00053158|alpha -ethylidene benzene acetaldehyde|AKOS025396900|2-Phenylacetaldehyde, alpha -ethylidene|Q27162088|BENZENEACETALDEHYDE, .ALPHA.-ETHYLIDENE-, (E)-|BENZENEACETALDEHYDE, .ALPHA.-ETHYLIDENE-, (.ALPHA.E)- |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 1.950 |
| Log Po/w (XLOGP3) : 2.180 |
| Log Po/w (WLOGP) : 2.290 |
| Log Po/w (MLOGP) : 2.310 |
| Log Po/w (SILICOS-IT) : 2.670 |
| Consensus Log Po/w : 2.280 |