TL;DR: Acetic acid, 2-(2-(4-chlorobenzyl)phenoxy)-, ethyl ester (CAS 71549-05-8) is a chemical compound with molecular formula C17H17ClO3 and molecular weight 304.0866 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[2-[(4-chlorophenyl)methyl]phenoxy]acetate
Also Known As: Sgd 14-74, Ethyl 2-(2-(4-chlorobenzyl)phenoxy)acetate, SGD-14-74, 2-(2-(4-Chlorobenzyl)phenoxy)acetic acid ethyl ester, 4-06-00-04638 (Beilstein Handbook Reference)
| Molecular Formula | C17H17ClO3 |
| Molecular Weight | 304.0866 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 304.0866 Da |
| Heavy Atoms | 21 |
| Complexity | 313.0 |
| SMILES | CCOC(=O)COC1=CC=CC=C1CC2=CC=C(C=C2)Cl |
| InChIKey | SXYMAGONWZFLSP-UHFFFAOYSA-N |
The XLogP value of 5.0 indicates that Acetic acid, 2-(2-(4-chlorobenzyl)phenoxy)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Acetic acid, 2-(2-(4-chlorobenzyl)phenoxy)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, 2-(2-(4-chlorobenzyl)phenoxy)-, ethyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Acetic acid, 2-(2-(4-chlorobenzyl)phenoxy)-, ethyl ester is 71549-05-8.
The molecular formula of Acetic acid, 2-(2-(4-chlorobenzyl)phenoxy)-, ethyl ester is C17H17ClO3.
The molecular weight of Acetic acid, 2-(2-(4-chlorobenzyl)phenoxy)-, ethyl ester is 304.0866 g/mol.
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