TL;DR: 2-ethylsulfanyl-3-methyl-2H-furan-5-one (CAS 148777-27-9) is a chemical compound with molecular formula C7H10O2S and molecular weight 158.04015 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethylsulfanyl-3-methyl-2H-furan-5-one
Also Known As: 5-(ethylthio)-4-methylfuran-2(5H)-one, 5-ethylsulfanyl-4-methyl-5H-furan-2-one
| Molecular Formula | C7H10O2S |
| Molecular Weight | 158.04015 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.04015 Da |
| Heavy Atoms | 10 |
| Complexity | 174.0 |
| SMILES | CCSC1C(=CC(=O)O1)C |
| InChIKey | HTPBTXDLGLQHIY-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-ethylsulfanyl-3-methyl-2H-furan-5-one. With a topological polar surface area (TPSA) of 51.6 Ų, 2-ethylsulfanyl-3-methyl-2H-furan-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-ethylsulfanyl-3-methyl-2H-furan-5-one has 0 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 2-ethylsulfanyl-3-methyl-2H-furan-5-one is 148777-27-9.
The molecular formula of 2-ethylsulfanyl-3-methyl-2H-furan-5-one is C7H10O2S.
The molecular weight of 2-ethylsulfanyl-3-methyl-2H-furan-5-one is 158.04015 g/mol.
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