TL;DR: 3-Furanol, tetrahydro-5,5-dimethyl-2-ethyl- (CAS 29839-59-6) is a chemical compound with molecular formula C8H16O2 and molecular weight 144.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethyl-5,5-dimethyloxolan-3-ol
Also Known As: 2-ethyl-5,5-dimethyloxolan-3-ol, 5,5-Dimethyl-2-ethyltetrahydro-3-furanol, 3-FURANOL, TETRAHYDRO-5,5-DIMETHYL-2-ETHYL-
| Molecular Formula | C8H16O2 |
| Molecular Weight | 144.11504 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 144.11504 Da |
| Heavy Atoms | 10 |
| Complexity | 120.0 |
| SMILES | CCC1C(CC(O1)(C)C)O |
| InChIKey | YKCGOADDFIPXPB-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Furanol, tetrahydro-5,5-dimethyl-2-ethyl-. With a topological polar surface area (TPSA) of 29.5 Ų, 3-Furanol, tetrahydro-5,5-dimethyl-2-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Furanol, tetrahydro-5,5-dimethyl-2-ethyl- has 1 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 3-Furanol, tetrahydro-5,5-dimethyl-2-ethyl- is 29839-59-6.
The molecular formula of 3-Furanol, tetrahydro-5,5-dimethyl-2-ethyl- is C8H16O2.
The molecular weight of 3-Furanol, tetrahydro-5,5-dimethyl-2-ethyl- is 144.11504 g/mol.
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