TL;DR: (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane (CAS 1402420-05-6) is a chemical compound with molecular formula C6H8O2 and molecular weight 112.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-(prop-2-ynoxymethyl)oxirane
Also Known As: (2S)-2-(prop-2-ynoxymethyl)oxirane, (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane, (S)-2-[(Prop-2-yn-1-yloxy)methyl]oxirane
| Molecular Formula | C6H8O2 |
| Molecular Weight | 112.05243 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.05243 Da |
| Heavy Atoms | 8 |
| Complexity | 111.0 |
| SMILES | C#CCOC[C@@H]1CO1 |
| InChIKey | SYFZCLMMUNCHNH-ZCFIWIBFSA-N |
The XLogP value of -0.1 indicates that (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 21.8 Ų, (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane is 1402420-05-6.
The molecular formula of (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane is C6H8O2.
The molecular weight of (S)-2-((prop-2-yn-1-yloxy)methyl)oxirane is 112.05243 g/mol.
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