1,7-Dimethoxyxanthone
PubChem CID: 15267570
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 1,7-dimethoxyxanthone, 1,7-dimethoxyxanthen-9-one, CHEBI:228326, AKOS040763031, 5042-06-8 |
|---|---|
| Topological Polar Surface Area | 44.8 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 19.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 343.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 1,7-dimethoxyxanthen-9-one |
| Prediction Hob | 1.0 |
| Xlogp | 2.9 |
| Molecular Formula | C15H12O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BFDXHXPAVMQXHZ-UHFFFAOYSA-N |
| Fcsp3 | 0.1333333333333333 |
| Logs | -4.046 |
| Rotatable Bond Count | 2.0 |
| Logd | 3.911 |
| Compound Name | 1,7-Dimethoxyxanthone |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 256.074 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 256.074 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 256.25 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.015556557894737 |
| Inchi | InChI=1S/C15H12O4/c1-17-9-6-7-11-10(8-9)15(16)14-12(18-2)4-3-5-13(14)19-11/h3-8H,1-2H3 |
| Smiles | COC1=CC2=C(C=C1)OC3=C(C2=O)C(=CC=C3)OC |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Polygala Tenuifolia (Plant) Rel Props:Source_db:cmaup_ingredients