TL;DR: (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate (CAS 114179-07-6) is a chemical compound with molecular formula C5H11NO3 and molecular weight 133.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate
Also Known As: (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate
| Molecular Formula | C5H11NO3 |
| Molecular Weight | 133.0739 g/mol |
| XLogP | -2.8 |
| Topological Polar Surface Area (TPSA) | 88.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 133.0739 Da |
| Heavy Atoms | 9 |
| Complexity | 120.0 |
| SMILES | C[C@@H]([C@@](C)(C(=O)[O-])[NH3+])O |
| InChIKey | NWZTXAMTDLRLFP-UCORVYFPSA-N |
The XLogP value of -2.8 indicates that (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate. Following Lipinski's Rule of Five, (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate 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 (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate is 114179-07-6.
The molecular formula of (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate is C5H11NO3.
The molecular weight of (2S,3S)-2-azaniumyl-3-hydroxy-2-methylbutanoate is 133.0739 g/mol.
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