TL;DR: 3-(4-propoxyphenyl)prop-2-enoic Acid (CAS 151539-67-2) is a chemical compound with molecular formula C12H14O3 and molecular weight 206.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-propoxyphenyl)prop-2-enoic acid
Also Known As: 4-Propoxycinnamic Acid, 3-(4-Propoxyphenyl)acrylic acid, 4-n-Propoxycinnamic acid, 4-propoxy cinnamic acid, (E)-3-(4-Propoxyphenyl)acrylic acid
| Molecular Formula | C12H14O3 |
| Molecular Weight | 206.0943 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 206.0943 Da |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
| SMILES | CCCOC1=CC=C(C=C1)C=CC(=O)O |
| InChIKey | WTYNDSOJMSGRQV-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-propoxyphenyl)prop-2-enoic Acid. With a topological polar surface area (TPSA) of 46.5 Ų, 3-(4-propoxyphenyl)prop-2-enoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-propoxyphenyl)prop-2-enoic Acid has 1 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 3-(4-propoxyphenyl)prop-2-enoic Acid is 151539-67-2.
The molecular formula of 3-(4-propoxyphenyl)prop-2-enoic Acid is C12H14O3.
The molecular weight of 3-(4-propoxyphenyl)prop-2-enoic Acid is 206.0943 g/mol.
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