TL;DR: 2-Chloroethyl vinyl ether (CAS 110-75-8) is a chemical compound with molecular formula C4H7ClO and molecular weight 106.01854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-2-ethenoxyethane
Also Known As: 2-CHLOROETHYL VINYL ETHER, (2-Chloroethoxy)ethene, Vinyl 2-chloroethyl ether, Ethene, (2-chloroethoxy)-, 2-Vinyloxyethyl chloride
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C4H7ClO |
| Molecular Weight | 106.01854 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 106.01854 Da |
| Heavy Atoms | 6 |
| Complexity | 36.0 |
| Melting Point | -94.5 °F (NTP, 1992) |
| Boiling Point | 228 °F at 760 mmHg (NTP, 1992) |
| Density | 1.0475 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 61 °F (NTP, 1992) |
| Vapor Pressure | 26.8 [mmHg] |
| Refractive Index | Index of refraction: 1.4378 @ 20 °C/D |
| Solubility | Very soluble in alcohol and ether; slightly soluble in chloroform |
| SMILES | C=COCCCl |
| InChIKey | DNJRKFKAFWSXSE-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroethyl vinyl ether. With a topological polar surface area (TPSA) of 9.2 Ų, 2-Chloroethyl vinyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroethyl vinyl ether 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 2-Chloroethyl vinyl ether is 110-75-8.
The molecular formula of 2-Chloroethyl vinyl ether is C4H7ClO.
The molecular weight of 2-Chloroethyl vinyl ether is 106.01854 g/mol.
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