TL;DR: Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester (CAS 132418-16-7) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[3-(2-hydroxyethyl)phenoxy]acetate
Also Known As: methyl [3-(2-hydroxyethyl)phenoxy]acetate, Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester, methyl [3-(2-hydroxyethyl)-phenoxy]acetate, Methyl 2-[3-(2-hydroxyethyl)phenoxy]acetate, Acetic acid, 2-[3-(2-hydroxyethyl)phenoxy]-, methyl ester
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.0892 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.0892 Da |
| Heavy Atoms | 15 |
| Complexity | 193.0 |
| SMILES | COC(=O)COC1=CC=CC(=C1)CCO |
| InChIKey | QPAJJQWPOWUYPL-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester. With a topological polar surface area (TPSA) of 55.8 Ų, Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester is 132418-16-7.
The molecular formula of Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester is C11H14O4.
The molecular weight of Acetic acid, [3-(2-hydroxyethyl)phenoxy]-, methyl ester is 210.0892 g/mol.
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