TL;DR: (S)-tetrahydro-2H-pyran-3-carbaldehyde (CAS 141822-85-7) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-oxane-3-carbaldehyde
Also Known As: (3S)-oxane-3-carbaldehyde, (S)-tetrahydro-2H-pyran-3-carbaldehyde, (3S)-tetrahydropyran-3-carbaldehyde, tetrahydro-2H-pyran-3-carbaldehyde, J1.079.097B
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H10O2 |
| Molecular Weight | 114.06808 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 114.06808 Da |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
| SMILES | C1C[C@@H](COC1)C=O |
| InChIKey | KYHPVAHPKYNKOR-ZCFIWIBFSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-tetrahydro-2H-pyran-3-carbaldehyde. With a topological polar surface area (TPSA) of 26.3 Ų, (S)-tetrahydro-2H-pyran-3-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-tetrahydro-2H-pyran-3-carbaldehyde 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)-tetrahydro-2H-pyran-3-carbaldehyde is 141822-85-7.
The molecular formula of (S)-tetrahydro-2H-pyran-3-carbaldehyde is C6H10O2.
The molecular weight of (S)-tetrahydro-2H-pyran-3-carbaldehyde is 114.06808 g/mol.
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