TL;DR: methyl (3R)-3-amino-3-(2-methylphenyl)propanoate (CAS 1212853-30-9) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (3R)-3-amino-3-(2-methylphenyl)propanoate
Also Known As: methyl (3R)-3-amino-3-(2-methylphenyl)propanoate, Methyl (R)-3-amino-3-(o-tolyl)propanoate, Methyl (3S)-3-amino-3-(2-methylphenyl)propanoate
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.11028 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 Da |
| Heavy Atoms | 14 |
| Complexity | 194.0 |
| SMILES | CC1=CC=CC=C1[C@@H](CC(=O)OC)N |
| InChIKey | OIKMAUPHKQQGOX-SNVBAGLBSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (3R)-3-amino-3-(2-methylphenyl)propanoate. With a topological polar surface area (TPSA) of 52.3 Ų, methyl (3R)-3-amino-3-(2-methylphenyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (3R)-3-amino-3-(2-methylphenyl)propanoate 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 methyl (3R)-3-amino-3-(2-methylphenyl)propanoate is 1212853-30-9.
The molecular formula of methyl (3R)-3-amino-3-(2-methylphenyl)propanoate is C11H15NO2.
The molecular weight of methyl (3R)-3-amino-3-(2-methylphenyl)propanoate is 193.11028 g/mol.
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