TL;DR: Acetic acid, (dimethylphenoxy)-, 2-(2-butoxyethoxy)ethyl ester (CAS 63904-85-8) is a chemical compound with molecular formula C18H28O5 and molecular weight 324.19366 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-butoxyethoxy)ethyl 2-methyl-2-phenoxypropanoate
Also Known As: Oxyfen A [Czech], Oxyfen A, Acetic acid, xyloxy-, 2-(2'-butoxyethoxy)ethyl ester, ACETIC ACID, (DIMETHYLPHENOXY)-, 2-(2-BUTOXYETHOXY)ETHYL ESTER, 2-(2'-n-Butoxyethoxy)ethylester kyseliny xyloxyoctove
| Molecular Formula | C18H28O5 |
| Molecular Weight | 324.19366 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 324.19366 Da |
| Heavy Atoms | 23 |
| Complexity | 311.0 |
| SMILES | CCCCOCCOCCOC(=O)C(C)(C)OC1=CC=CC=C1 |
| InChIKey | BIDQATLLXWQCIA-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that Acetic acid, (dimethylphenoxy)-, 2-(2-butoxyethoxy)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, Acetic acid, (dimethylphenoxy)-, 2-(2-butoxyethoxy)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (dimethylphenoxy)-, 2-(2-butoxyethoxy)ethyl ester 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 Acetic acid, (dimethylphenoxy)-, 2-(2-butoxyethoxy)ethyl ester is 63904-85-8.
The molecular formula of Acetic acid, (dimethylphenoxy)-, 2-(2-butoxyethoxy)ethyl ester is C18H28O5.
The molecular weight of Acetic acid, (dimethylphenoxy)-, 2-(2-butoxyethoxy)ethyl ester is 324.19366 g/mol.
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