3-Octanol
Representations & DB's id
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| ChEBI: | CHEBI:80945 | |
|---|---|---|
| ChEMBL: | CHEMBL487998 | |
| PubChem: | 11527 | |
| IUPAC: | octan-3-ol | |
| Standard InChI: | InChI=1S/C8H18O/c1-3-5-6-7-8(9)4-2/h8-9H,3-7H2,1-2H3 | |
| Standard InChI Key: | NMRPBPVERJPACX-UHFFFAOYSA-N | |
| SMILES: | CCCCCC(CC)O | |
Molecular propeties
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| AlogP: | 2.34 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 5 | |
| Number of rings: | 0 | |
| Molecular Weight: | 130.14 | |
| Topological polar surface area: | 20.2 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 1 | |
| Number of carbons: | 8 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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