7,7'-Dimethoxy-8,8'-bicoumarin
PubChem CID: 14282779
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 7,7'-dimethoxy-8,8'-bicoumarin |
|---|---|
| Topological Polar Surface Area | 71.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 26.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 572.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 7-methoxy-8-(7-methoxy-2-oxochromen-8-yl)chromen-2-one |
| Prediction Hob | 1.0 |
| Xlogp | 3.5 |
| Molecular Formula | C20H14O6 |
| Prediction Swissadme | 0.0 |
| Inchi Key | IOLIWNMGVYEBIW-UHFFFAOYSA-N |
| Fcsp3 | 0.1 |
| Logs | -5.497 |
| Rotatable Bond Count | 3.0 |
| Logd | 2.413 |
| Compound Name | 7,7'-Dimethoxy-8,8'-bicoumarin |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 350.079 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 350.079 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 350.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -2.43995196923077 |
| Inchi | InChI=1S/C20H14O6/c1-23-13-7-3-11-5-9-15(21)25-19(11)17(13)18-14(24-2)8-4-12-6-10-16(22)26-20(12)18/h3-10H,1-2H3 |
| Smiles | COC1=C(C2=C(C=C1)C=CC(=O)O2)C3=C(C=CC4=C3OC(=O)C=C4)OC |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Boenninghausenia Albiflora (Plant) Rel Props:Source_db:cmaup_ingredients