TL;DR: Ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate (CAS 312318-86-8) is a chemical compound with molecular formula C15H16O5 and molecular weight 276.09976 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(4,8-dimethyl-2-oxochromen-7-yl)oxyacetate
Also Known As: AB00332764-02, ethyl 2-(4,8-dimethyl-2-oxochromen-7-yl)oxyacetate, ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate, ethyl [(4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetate, ethyl 2-((4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy)acetate
| Molecular Formula | C15H16O5 |
| Molecular Weight | 276.09976 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 276.09976 Da |
| Heavy Atoms | 20 |
| Complexity | 414.0 |
| SMILES | CCOC(=O)COC1=C(C2=C(C=C1)C(=CC(=O)O2)C)C |
| InChIKey | IRJCKCYPLUGXFZ-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate. Following Lipinski's Rule of Five, Ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate is 312318-86-8.
The molecular formula of Ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate is C15H16O5.
The molecular weight of Ethyl 2-(4,8-dimethyl-2-oxochromen-7-yloxy)acetate is 276.09976 g/mol.
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