TL;DR: (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone (CAS 1212090-38-4) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2S)-2,5,6-trimethyl-3,4-dihydropyran-2-yl]ethanone
Also Known As: 1-[(2S)-2,5,6-trimethyl-3,4-dihydropyran-2-yl]ethanone, (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone, 1-[(2S)-2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl]ethanone
| Molecular Formula | C10H16O2 |
| Molecular Weight | 168.11504 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.11504 Da |
| Heavy Atoms | 12 |
| Complexity | 240.0 |
| SMILES | CC1=C(O[C@](CC1)(C)C(=O)C)C |
| InChIKey | WBJNIPXRTMFVGW-JTQLQIEISA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone. With a topological polar surface area (TPSA) of 26.3 Ų, (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone has 0 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 (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone is 1212090-38-4.
The molecular formula of (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone is C10H16O2.
The molecular weight of (S)-1-(2,5,6-trimethyl-3,4-dihydro-2H-pyran-2-yl)ethanone is 168.11504 g/mol.
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