tert-butyl [(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
Chemical Structure Depiction of
tert-butyl [(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
tert-butyl [(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate
Compound characteristics
| Compound ID: | Y041-6532 |
| Compound Name: | tert-butyl [(6-hexyl-2-oxo-4-phenyl-2H-1-benzopyran-7-yl)oxy]acetate |
| Molecular Weight: | 436.55 |
| Molecular Formula: | C27 H32 O5 |
| Smiles: | CCCCCCc1cc2C(=CC(=O)Oc2cc1OCC(=O)OC(C)(C)C)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.9078 |
| logD: | 6.9078 |
| logSw: | -5.6588 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.228 |
| InChI Key: | CGGVFRDAPKAYBB-UHFFFAOYSA-N |