TL;DR: Dihydroferulic Acid (CAS 1135-23-5) is a chemical compound with molecular formula C10H12O4 and molecular weight 196.07356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-hydroxy-3-methoxyphenyl)propanoic acid
Also Known As: dihydroferulic acid, Hydroferulic acid, 3-(4-Hydroxy-3-methoxyphenyl)propanoic acid, 3-(4-Hydroxy-3-methoxyphenyl)propionic acid, Dihydroconiferylic acid
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H12O4 |
| Molecular Weight | 196.07356 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.07356 Da |
| Heavy Atoms | 14 |
| Complexity | 193.0 |
| SMILES | COC1=C(C=CC(=C1)CCC(=O)O)O |
| InChIKey | BOLQJTPHPSDZHR-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydroferulic Acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydroferulic Acid. Following Lipinski's Rule of Five, Dihydroferulic Acid has 2 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 Dihydroferulic Acid is 1135-23-5.
The molecular formula of Dihydroferulic Acid is C10H12O4.
The molecular weight of Dihydroferulic Acid is 196.07356 g/mol.
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