3-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid
Chemical Structure Depiction of
3-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid
3-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid
Compound characteristics
| Compound ID: | D143-0281 |
| Compound Name: | 3-(3-tert-butyl-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoic acid |
| Molecular Weight: | 328.36 |
| Molecular Formula: | C19 H20 O5 |
| Smiles: | CC1=C(CCC(O)=O)C(=O)Oc2cc3c(cc12)c(co3)C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 3.7075 |
| logD: | 1.2112 |
| logSw: | -3.9286 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.104 |
| InChI Key: | RSZGOILSNWBLCB-UHFFFAOYSA-N |