TL;DR: (3S)-3-Amino-4,4-dimethyloxolan-2-one (CAS 157717-59-4) is a chemical compound with molecular formula C6H11NO2 and molecular weight 129.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-3-amino-4,4-dimethyloxolan-2-one
Also Known As: (3S)-3-Amino-4,4-dimethyloxolan-2-one, (3S)-3-amino-4,4-dimethyl-oxolan-2-one, (3S)-3-Aminodihydro-4,4-dimethyl-2(3H)-furanone, 2(3H)-Furanone,3-aminodihydro-4,4-dimethyl-,(3S)-(9CI), 2(3H)-Furanone, 3-aminodihydro-4,4-dimethyl-, (3S)- (9CI)
| Molecular Formula | C6H11NO2 |
| Molecular Weight | 129.07898 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 129.07898 Da |
| Heavy Atoms | 9 |
| Complexity | 142.0 |
| SMILES | CC1(COC(=O)[C@H]1N)C |
| InChIKey | FTLXLFPMDCOABE-SCSAIBSYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3S)-3-Amino-4,4-dimethyloxolan-2-one. With a topological polar surface area (TPSA) of 52.3 Ų, (3S)-3-Amino-4,4-dimethyloxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S)-3-Amino-4,4-dimethyloxolan-2-one 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 (3S)-3-Amino-4,4-dimethyloxolan-2-one is 157717-59-4.
The molecular formula of (3S)-3-Amino-4,4-dimethyloxolan-2-one is C6H11NO2.
The molecular weight of (3S)-3-Amino-4,4-dimethyloxolan-2-one is 129.07898 g/mol.
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