TL;DR: cis-2,3-Divinyloxirane (CAS 13051-60-0) is a chemical compound with molecular formula C6H8O and molecular weight 96.05752 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R)-2,3-bis(ethenyl)oxirane
Also Known As: cis-2,3-Divinyloxirane, cis-divinyloxirane, (2r,3s)-2,3-divinyloxirane, 2beta,3beta-Divinyloxirane, 2alpha,3alpha-Divinyloxirane
| Molecular Formula | C6H8O |
| Molecular Weight | 96.05752 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 96.05752 Da |
| Heavy Atoms | 7 |
| Complexity | 84.0 |
| SMILES | C=C[C@@H]1[C@@H](O1)C=C |
| InChIKey | WVLXAFYCRVAZSM-OLQVQODUSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-2,3-Divinyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, cis-2,3-Divinyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-2,3-Divinyloxirane has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of cis-2,3-Divinyloxirane is 13051-60-0.
The molecular formula of cis-2,3-Divinyloxirane is C6H8O.
The molecular weight of cis-2,3-Divinyloxirane is 96.05752 g/mol.
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