2-Hydroxy-1-methoxyxanthone
PubChem CID: 10399460
Connections displayed (default: 10).
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| Compound Synonyms | 2-Hydroxy-1-methoxyxanthone, 2-hydroxy-1-methoxy-xanthen-9-one, 16302-46-8, 7-hydroxy-8-methoxyxanthone, CHEMBL1923834, AKOS040763029, 9H-Xanthen-9-one, 2-hydroxy-1-methoxy- |
|---|---|
| Topological Polar Surface Area | 55.8 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 18.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 330.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 2-hydroxy-1-methoxyxanthen-9-one |
| Prediction Hob | 1.0 |
| Xlogp | 2.6 |
| Molecular Formula | C14H10O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ATPZBKJDXXSOFC-UHFFFAOYSA-N |
| Fcsp3 | 0.0714285714285714 |
| Logs | -3.485 |
| Rotatable Bond Count | 1.0 |
| Logd | 2.663 |
| Compound Name | 2-Hydroxy-1-methoxyxanthone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 242.058 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 242.058 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 242.23 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.8169815555555555 |
| Inchi | InChI=1S/C14H10O4/c1-17-14-9(15)6-7-11-12(14)13(16)8-4-2-3-5-10(8)18-11/h2-7,15H,1H3 |
| Smiles | COC1=C(C=CC2=C1C(=O)C3=CC=CC=C3O2)O |
| Nring | 3.0 |
| Defined Bond Stereocenter Count | 0.0 |
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