TL;DR: 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one (CAS 155326-50-4) is a chemical compound with molecular formula C17H22O5 and molecular weight 306.14673 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
8-(3-ethoxy-2-hydroxy-3-methylbutyl)-7-methoxychromen-2-one
Also Known As: Yuehgesin C, YuehgesinC, 3-Ethoxyacroleindiethylacetal, 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one, 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxycoumarin
| Molecular Formula | C17H22O5 |
| Molecular Weight | 306.14673 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 306.14673 Da |
| Heavy Atoms | 22 |
| Complexity | 417.0 |
| SMILES | CCOC(C)(C)C(CC1=C(C=CC2=C1OC(=O)C=C2)OC)O |
| InChIKey | ZEJUDJOXRYEYKX-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one. Following Lipinski's Rule of Five, 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one has 1 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 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one is 155326-50-4.
The molecular formula of 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one is C17H22O5.
The molecular weight of 8-(3-Ethoxy-2-hydroxy-3-methylbutyl)-7-methoxy-2H-chromen-2-one is 306.14673 g/mol.
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