TL;DR: 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid (CAS 1217976-32-3) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-(4-hydroxyphenyl)-4-methylpentanoic acid
Also Known As: 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid, 2-amino-3-(4-hydroxyphenyl)-4-methylpentanoic acid
| Molecular Formula | C12H17NO3 |
| Molecular Weight | 223.12085 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 223.12085 Da |
| Heavy Atoms | 16 |
| Complexity | 234.0 |
| SMILES | CC(C)C(C1=CC=C(C=C1)O)C(C(=O)O)N |
| InChIKey | KWYZTHVAWKERSM-UHFFFAOYSA-N |
The XLogP value of -0.6 indicates that 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid. Following Lipinski's Rule of Five, 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid has 3 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 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid is 1217976-32-3.
The molecular formula of 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid is C12H17NO3.
The molecular weight of 2-amino-3-(4-hydroxyphenyl)-4-methyl-pentanoic Acid is 223.12085 g/mol.
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