TL;DR: 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl- (CAS 101833-11-8) is a chemical compound with molecular formula C7H6F6O3 and molecular weight 252.02211 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-2-methyl-5,5-bis(trifluoromethyl)oxolan-3-one
Also Known As: 2-hydroxy-2-methyl-5,5-bis(trifluoromethyl)oxolan-3-one, 2-Hydroxy-5,5-bis(trifluoromethyl)-2-methyl-3(2H)-dihydrofuranone, 3(2H)-FURANONE, DIHYDRO-5,5-BIS(TRIFLUOROMETHYL)-2-HYDROXY-2-METHYL-, 3(2H)-Furanone,dihydro-2-hydroxy-2-methyl-5,5-bis(trifluoromethyl)-, Dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl-3(2H)-furanone
| Molecular Formula | C7H6F6O3 |
| Molecular Weight | 252.02211 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 252.02211 Da |
| Heavy Atoms | 16 |
| Complexity | 305.0 |
| SMILES | CC1(C(=O)CC(O1)(C(F)(F)F)C(F)(F)F)O |
| InChIKey | MWYNNQGRHMWJIV-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl-. With a topological polar surface area (TPSA) of 46.5 Ų, 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl- has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl- is 101833-11-8.
The molecular formula of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl- is C7H6F6O3.
The molecular weight of 3(2H)-Furanone, dihydro-5,5-bis(trifluoromethyl)-2-hydroxy-2-methyl- is 252.02211 g/mol.
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