| Phytochemical Name : 3-Butenoic acid, ethyl ester |
| PCNDIDOT0753 |
| Pubchem CID : 74172 |
| Molecular formula: C6H10O2 |
| Canonical SMILES : CCOC(=O)CC=C |
Synonymes : 1617-18-1|Ethyl 3-butenoate|ethyl but-3-enoate|3-BUTENOIC ACID, ETHYL ESTER|BUT-3-ENOIC ACID ETHYL ESTER|AI3-17636|3-Butenoic acid, ethylester|ethyl vinylacetate|ethylbut-3-enoate|SCHEMBL23027|vinyl acetic acid ethyl ester|DTXSID9074698|SCHEMBL12115337|AMY30553|NSC44507|MFCD07779251|NSC 44507|NSC-44507|AKOS024260320|SB34050|FT-0693317|Benzenepropanoic acid, 4-bromo-.beta.-oxo-, ethyl ester|BUT-3-ENOIC ACID ETHYL ESTER (CONTAINS <30PPM MEHQ AS INHIBITOR) |
| Structure | |
| 3D structure | 2D structure |
 |
| Log Po/w (iLOGP) : 2.070 |
| Log Po/w (XLOGP3) : 1.230 |
| Log Po/w (WLOGP) : 1.130 |
| Log Po/w (MLOGP) : 1.170 |
| Log Po/w (SILICOS-IT) : 1.070 |
| Consensus Log Po/w : 1.330 |