TL;DR: (3R)-3-Amino-3-(4-nitrophenyl)propanoic acid (CAS 102308-62-3) is a chemical compound with molecular formula C9H10N2O4 and molecular weight 210.06406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R)-3-amino-3-(4-nitrophenyl)propanoic acid
Also Known As: (r)-3-(p-nitrophenyl)-beta-alanine, (3R)-3-amino-3-(4-nitrophenyl)propanoic acid, h-d-beta-phe(4-no2)-oh, (r)-3-amino-3-(4-nitrophenyl)propanoic acid, p-nitro-beta-phenylalanine
| Molecular Formula | C9H10N2O4 |
| Molecular Weight | 210.06406 g/mol |
| XLogP | -1.6 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.06406 Da |
| Heavy Atoms | 15 |
| Complexity | 243.0 |
| SMILES | C1=CC(=CC=C1[C@@H](CC(=O)O)N)[N+](=O)[O-] |
| InChIKey | JVQPVKJZKRICRR-MRVPVSSYSA-N |
The XLogP value of -1.6 indicates that (3R)-3-Amino-3-(4-nitrophenyl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R)-3-Amino-3-(4-nitrophenyl)propanoic acid. Following Lipinski's Rule of Five, (3R)-3-Amino-3-(4-nitrophenyl)propanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (3R)-3-Amino-3-(4-nitrophenyl)propanoic acid is 102308-62-3.
The molecular formula of (3R)-3-Amino-3-(4-nitrophenyl)propanoic acid is C9H10N2O4.
The molecular weight of (3R)-3-Amino-3-(4-nitrophenyl)propanoic acid is 210.06406 g/mol.
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