Hexanal
Representations & DB's id
| ||
| ChEBI: | CHEBI:88528 | |
|---|---|---|
| ChEMBL: | CHEMBL280331 | |
| PubChem: | 6184 | |
| IUPAC: | hexanal | |
| Standard InChI: | InChI=1S/C6H12O/c1-2-3-4-5-6-7/h6H,2-5H2,1H3 | |
| Standard InChI Key: | JARKCYVAAOWBJS-UHFFFAOYSA-N | |
| SMILES: | CCCCCC=O | |
Molecular propeties
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| AlogP: | 1.77 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 0 | |
| Molecular Weight: | 100.09 | |
| Topological polar surface area: | 17.1 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.833 | |
| Number of carbons: | 6 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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