9-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
9-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione
Also Known As: ChemDiv1_001049|Oprea1_380205|Oprea1_549254|HMS589P15|9-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione|J2.309.048A|AG-205/07770001|SR-01000406428-1|9-(4-HYDROXY-3-METHOXYPHENYL)-2,3,4,5,6,7,8,9-OCTAHYDRO-1H-XANTHENE-1,8-DIONE|9-(4-hydroxy-3-methoxyphenyl)-2,3,4,5,6,7-hexahydroxanthene-1,8-dione|9-(3-Methoxy-4-hydroxyphenyl)-3,4,5,6-tetrahydro-9H-xanthene-1,8(2H,7H)-dione|9-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione
| Molecular Formula | C20H20O5 |
|---|---|
| Molecular Weight | 340.13107 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.13107 |
| Monoisotopic Mass | 340.13107 |
| Heavy Atoms | 25 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 102159-41-1 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)O |
| InChIKey | UMPROAWIQHDPNU-UHFFFAOYSA-N |
Product Overview
9-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione (CAS 102159-41-1), with molecular formula C20H20O5 and molecular weight 340.13107 g/mol. IUPAC: 9-(4-hydroxy-3-methoxyphenyl)-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione.