1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)ethan-1-one
Chemical Structure Depiction of
1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)ethan-1-one
1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)ethan-1-one
Compound characteristics
| Compound ID: | 0495-0006 |
| Compound Name: | 1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopentaoxacyclopentadecin-15-yl)ethan-1-one |
| Molecular Weight: | 310.35 |
| Molecular Formula: | C16 H22 O6 |
| Smiles: | CC(c1ccc2c(c1)OCCOCCOCCOCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1671 |
| logD: | 0.1671 |
| logSw: | -1.4746 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.945 |
| InChI Key: | XNJYHEGDUAQGEE-UHFFFAOYSA-N |