TL;DR: (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID (CAS 1311254-87-1) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-3-(4-hydroxy-2,6-dimethylphenyl)-2-methylpropanoic acid
Also Known As: (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID, (R)-3-(4-Hydroxy-2,6-dimethylphenyl)-2-methylpropanoic acid, (R)-3-(4-Hydroxy-2,6-dimethylphenyl)-2-methylpropanoicacid, Benzenepropanoic acid, 4-hydroxy-I+/-,2,6-trimethyl-, (I+/-R)-, (2R)-3-(4-HYDROXY-2,6-DIMETHYLPHENYL)-2-METHYLPROPANOIC ACID
| Molecular Formula | C12H16O3 |
| Molecular Weight | 208.10994 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.10994 Da |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
| SMILES | CC1=CC(=CC(=C1C[C@@H](C)C(=O)O)C)O |
| InChIKey | LPPITBJXYYCDEQ-SECBINFHSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID. With a topological polar surface area (TPSA) of 57.5 Ų, (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID has 2 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 (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID is 1311254-87-1.
The molecular formula of (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID is C12H16O3.
The molecular weight of (R)-3-(4-HYDROXY-2,6-DIMETHYL-PHENYL)-2-METHYL-PROPIONIC ACID is 208.10994 g/mol.
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