TL;DR: 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate (CAS 155801-51-7) is a chemical compound with molecular formula C14H14O6 and molecular weight 278.07904 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5,7-dimethoxy-4-methyl-2-oxochromen-6-yl) acetate
Also Known As: 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate, NCI60_031999, (5,7-dimethoxy-4-methyl-2-oxochromen-6-yl) acetate, (5,7-dimethoxy-4-methyl-2-oxo-chromen-6-yl) acetate
| Molecular Formula | C14H14O6 |
| Molecular Weight | 278.07904 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.07904 Da |
| Heavy Atoms | 20 |
| Complexity | 429.0 |
| SMILES | CC1=CC(=O)OC2=CC(=C(C(=C12)OC)OC(=O)C)OC |
| InChIKey | GHCXYHOPWWGQAI-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate. Following Lipinski's Rule of Five, 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate is 155801-51-7.
The molecular formula of 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate is C14H14O6.
The molecular weight of 5,7-Dimethoxy-4-methyl-2-oxo-2H-chromen-6-yl acetate is 278.07904 g/mol.
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