TL;DR: 4-Ethoxy-3-methoxyphenylacetic acid (CAS 120-13-8) 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.
2-(4-ethoxy-3-methoxyphenyl)acetic acid
Also Known As: 4-Ethoxy-3-methoxyphenylacetic acid, 2-(4-ethoxy-3-methoxyphenyl)acetic acid, (4-ethoxy-3-methoxyphenyl)acetic acid, rarechem al bo 0342, Benzeneacetic acid, 4-ethoxy-3-methoxy-
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.0892 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.0892 Da |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
| SMILES | CCOC1=C(C=C(C=C1)CC(=O)O)OC |
| InChIKey | XVNXRPVJRCYHEW-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethoxy-3-methoxyphenylacetic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 4-Ethoxy-3-methoxyphenylacetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethoxy-3-methoxyphenylacetic acid 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 4-Ethoxy-3-methoxyphenylacetic acid is 120-13-8.
The molecular formula of 4-Ethoxy-3-methoxyphenylacetic acid is C11H14O4.
The molecular weight of 4-Ethoxy-3-methoxyphenylacetic acid is 210.0892 g/mol.
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