TL;DR: 2-Prop-1-enyl-1,3-dioxolane (CAS 96424-44-1) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-prop-1-enyl-1,3-dioxolane
Also Known As: 2-Butenal ethylene acetal, 2-prop-1-enyl-1,3-dioxolane, 1,3-Dioxolane, 2-(1E)-1-propenyl-
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H10O2 |
| Molecular Weight | 114.06808 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 114.06808 Da |
| Heavy Atoms | 8 |
| Complexity | 82.0 |
| SMILES | CC=CC1OCCO1 |
| InChIKey | WJTBAEFOGKJWNP-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Prop-1-enyl-1,3-dioxolane. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Prop-1-enyl-1,3-dioxolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Prop-1-enyl-1,3-dioxolane 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 2-Prop-1-enyl-1,3-dioxolane is 96424-44-1.
The molecular formula of 2-Prop-1-enyl-1,3-dioxolane is C6H10O2.
The molecular weight of 2-Prop-1-enyl-1,3-dioxolane is 114.06808 g/mol.
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