TL;DR: (2S)-2-(diethoxymethyl)oxirane (CAS 128572-83-8) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.0943 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(diethoxymethyl)oxirane
Also Known As: (2S)-2-(diethoxymethyl)oxirane, 2-(diethoxymethyl)oxirane, (S)-2-(Diethoxymethyl)oxirane, (S)-Oxirane-2alpha-carbaldehyde diethyl acetal
| Molecular Formula | C7H14O3 |
| Molecular Weight | 146.0943 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 31.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 146.0943 Da |
| Heavy Atoms | 10 |
| Complexity | 88.0 |
| SMILES | CCOC([C@@H]1CO1)OCC |
| InChIKey | QIQQWSQARNQPLP-LURJTMIESA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(diethoxymethyl)oxirane. With a topological polar surface area (TPSA) of 31.0 Ų, (2S)-2-(diethoxymethyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-2-(diethoxymethyl)oxirane has 0 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)-2-(diethoxymethyl)oxirane is 128572-83-8.
The molecular formula of (2S)-2-(diethoxymethyl)oxirane is C7H14O3.
The molecular weight of (2S)-2-(diethoxymethyl)oxirane is 146.0943 g/mol.
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