TL;DR: 1-(2-Furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol (CAS 106165-88-2) is a chemical compound with molecular formula C13H16O3 and molecular weight 220.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-(furan-2-yl)-3-hydroxyprop-1-ynyl]cyclohexan-1-ol
Also Known As: ZERO/005648, 1-(2-furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol, 1-(3-(Furan-2-yl)-3-hydroxyprop-1-yn-1-yl)cyclohexan-1-ol, 1-[3-(2-Furyl)-3-hydroxyprop-1-yn-1-yl]cyclohexanol, 1-[3-(furan-2-yl)-3-hydroxyprop-1-ynyl]cyclohexan-1-ol
| Molecular Formula | C13H16O3 |
| Molecular Weight | 220.10994 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.10994 Da |
| Heavy Atoms | 16 |
| Complexity | 293.0 |
| SMILES | C1CCC(CC1)(C#CC(C2=CC=CO2)O)O |
| InChIKey | AVPXAXGYNOEKEA-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol. With a topological polar surface area (TPSA) of 53.6 Ų, 1-(2-Furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol has 2 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 1-(2-Furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol is 106165-88-2.
The molecular formula of 1-(2-Furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol is C13H16O3.
The molecular weight of 1-(2-Furyl)-3-(hydroxycyclohexyl)prop-2-yn-1-ol is 220.10994 g/mol.
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