1,7-Dihydroxyxanthone
Representations & DB's id
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| ChEBI: | CHEBI:4946 | |
|---|---|---|
| ChEMBL: | CHEMBL389166 | |
| PubChem: | 5281631 | |
| IUPAC: | 1,7-dihydroxyxanthen-9-one | |
| Standard InChI: | InChI=1S/C13H8O4/c14-7-4-5-10-8(6-7)13(16)12-9(15)2-1-3-11(12)17-10/h1-6,14-15H | |
| Standard InChI Key: | KDXFPEKLLFWHMN-UHFFFAOYSA-N | |
| SMILES: | Oc1ccc2c(c1)c(=O)c1c(o2)cccc1O | |
Molecular propeties
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| AlogP: | 2.36 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 228.04 | |
| Topological polar surface area: | 66.8 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0 | |
| Number of carbons: | 13 | |