2,4-Hexadienal
Representations & DB's id
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| ChEBI: | CHEBI:82334 | |
|---|---|---|
| ChEMBL: | CHEMBL1576086 | |
| PubChem: | 637564 | |
| IUPAC: | (2E,4E)-hexa-2,4-dienal | |
| Standard InChI: | InChI=1S/C6H8O/c1-2-3-4-5-6-7/h2-6H,1H3/b3-2+,5-4+ | |
| Standard InChI Key: | BATOPAZDIZEVQF-MQQKCMAXSA-N | |
| SMILES: | C/C=C/C=C/C=O | |
Molecular propeties
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| AlogP: | 1.32 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 0 | |
| Molecular Weight: | 96.06 | |
| Topological polar surface area: | 17.1 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.167 | |
| Number of carbons: | 6 | |