TL;DR: Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)- (CAS 16386-43-9) is a chemical compound with molecular formula C15H22O5 and molecular weight 282.14673 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[2-(2-butoxyethoxy)ethoxy]-1,3-benzodioxole
Also Known As: 5-[2-(2-butoxyethoxy)ethoxy]-1,3-benzodioxole, Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)-, 1,3-Benzodioxole, 5-(2-(2-butoxyethoxy)ethoxy)-, 4-19-00-00722 (Beilstein Handbook Reference), 1,3-Benzodioxole, 5-[2-(2-butoxyethoxy)ethoxy]-
| Molecular Formula | C15H22O5 |
| Molecular Weight | 282.14673 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 282.14673 Da |
| Heavy Atoms | 20 |
| Complexity | 248.0 |
| SMILES | CCCCOCCOCCOC1=CC2=C(C=C1)OCO2 |
| InChIKey | XGFMWQQUKDCKNY-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)-. With a topological polar surface area (TPSA) of 46.2 Ų, Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)- 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 Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)- is 16386-43-9.
The molecular formula of Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)- is C15H22O5.
The molecular weight of Benzene, 4-(2-(2-butoxyethoxy)ethoxy)-1,2-(methylenedioxy)- is 282.14673 g/mol.
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