Perillaldehyde
Representations & DB's id
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| ChEBI: | CHEBI:15421 | |
|---|---|---|
| ChEMBL: | CHEMBL469537 | |
| PubChem: | 16441 | |
| IUPAC: | 4-prop-1-en-2-ylcyclohexene-1-carbaldehyde | |
| Standard InChI: | InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3 | |
| Standard InChI Key: | RUMOYJJNUMEFDD-UHFFFAOYSA-N | |
| SMILES: | O=CC1=CCC(CC1)C(=C)C | |
Molecular propeties
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| AlogP: | 2.49 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 1 | |
| Molecular Weight: | 150.1 | |
| Topological polar surface area: | 17.1 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.5 | |
| Number of carbons: | 10 | |