Crotonaldehyde
Representations & DB's id
| ||
| ChEBI: | CHEBI:41607 | |
|---|---|---|
| ChEMBL: | CHEMBL1086445 | |
| PubChem: | 447466 | |
| IUPAC: | (E)-but-2-enal | |
| Standard InChI: | InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2+ | |
| Standard InChI Key: | MLUCVPSAIODCQM-NSCUHMNNSA-N | |
| SMILES: | C/C=C/C=O | |
Molecular propeties
| ||
| AlogP: | 0.76 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 0 | |
| Molecular Weight: | 70.04 | |
| Topological polar surface area: | 17.1 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.25 | |
| Number of carbons: | 4 | |