1-Hydroxy-2-Methoxyanthracene-9,10-Dione
Representations & DB's id
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| ChEBI: | CHEBI:2575 | |
|---|---|---|
| ChEMBL: | CHEMBL451977 | |
| PubChem: | 80103 | |
| IUPAC: | 1-hydroxy-2-methoxyanthracene-9,10-dione | |
| Standard InChI: | InChI=1S/C15H10O4/c1-19-11-7-6-10-12(15(11)18)14(17)9-5-3-2-4-8(9)13(10)16/h2-7,18H,1H3 | |
| Standard InChI Key: | BYQWRZGQEZAOPQ-UHFFFAOYSA-N | |
| SMILES: | COc1ccc2c(c1O)C(=O)c1c(C2=O)cccc1 | |
Molecular propeties
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| AlogP: | 2.18 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 3 | |
| Molecular Weight: | 254.06 | |
| Topological polar surface area: | 63.6 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.067 | |
| Number of carbons: | 15 | |