6-butyl-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-8-one
Chemical Structure Depiction of
6-butyl-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-8-one
6-butyl-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-8-one
Compound characteristics
| Compound ID: | Y040-3569 |
| Compound Name: | 6-butyl-3,4-dihydro-8H-spiro[benzo[1,2-b:5,4-b']dipyran-2,1'-cyclohexan]-8-one |
| Molecular Weight: | 326.43 |
| Molecular Formula: | C21 H26 O3 |
| Smiles: | CCCCC1=CC(=O)Oc2cc3c(CCC4(CCCCC4)O3)cc12 |
| Stereo: | ACHIRAL |
| logP: | 5.6551 |
| logD: | 5.6551 |
| logSw: | -5.367 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.3814 |
| InChI Key: | GKRZYSKXMVXJSR-UHFFFAOYSA-N |