TL;DR: (4-Ethylphenyl)acetic acid (CAS 14387-10-1) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-ethylphenyl)acetic acid
Also Known As: (4-ethylphenyl)acetic acid, 2-(4-ethylphenyl)acetic acid, Benzeneacetic acid, 4-ethyl-, 4-Ethylphenylacetic acid, 4-Ethylbenzeneacetic acid
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H12O2 |
| Molecular Weight | 164.08372 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.08372 Da |
| Heavy Atoms | 12 |
| Complexity | 146.0 |
| SMILES | CCC1=CC=C(C=C1)CC(=O)O |
| InChIKey | QMBLXRHXCGJOGU-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Ethylphenyl)acetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (4-Ethylphenyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Ethylphenyl)acetic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4-Ethylphenyl)acetic acid is 14387-10-1.
The molecular formula of (4-Ethylphenyl)acetic acid is C10H12O2.
The molecular weight of (4-Ethylphenyl)acetic acid is 164.08372 g/mol.
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