Raspberryketone
Representations & DB's id
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| ChEBI: | CHEBI:68656 | |
|---|---|---|
| ChEMBL: | CHEMBL105912 | |
| PubChem: | 21648 | |
| IUPAC: | 4-(4-hydroxyphenyl)butan-2-one | |
| Standard InChI: | InChI=1S/C10H12O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-7,12H,2-3H2,1H3 | |
| Standard InChI Key: | NJGBTKGETPDVIK-UHFFFAOYSA-N | |
| SMILES: | CC(=O)CCc1ccc(cc1)O | |
Molecular propeties
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| AlogP: | 1.91 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 3 | |
| Number of rings: | 1 | |
| Molecular Weight: | 164.08 | |
| Topological polar surface area: | 37.3 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.3 | |
| Number of carbons: | 10 | |