TL;DR: 5-(tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone (CAS 137881-51-7) is a chemical compound with molecular formula C9H12O3 and molecular weight 168.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2-[(2S)-oxan-2-yl]-2H-furan-5-one
Also Known As: Thp-furanone, (2R)-2-[(2S)-oxan-2-yl]-2H-furan-5-one, 5-(Tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone, (5R)-5-[(2S)-Oxan-2-yl]furan-2(5H)-one, (R*,S*)-(+)(-)-5-(Tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone
| Molecular Formula | C9H12O3 |
| Molecular Weight | 168.07864 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.07864 Da |
| Heavy Atoms | 12 |
| Complexity | 210.0 |
| SMILES | C1CCO[C@@H](C1)[C@H]2C=CC(=O)O2 |
| InChIKey | NLYACRFEAFZTNA-JGVFFNPUSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone. With a topological polar surface area (TPSA) of 35.5 Ų, 5-(tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone 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 5-(tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone is 137881-51-7.
The molecular formula of 5-(tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone is C9H12O3.
The molecular weight of 5-(tetrahydro-2'H-pyran-2'-yl)-2(5H)-furanone is 168.07864 g/mol.
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