Tetrahydro-4H-pyran-4-one
TL;DR: Tetrahydro-4H-pyran-4-one (CAS 29943-42-8) is a chemical compound with molecular formula C5H8O2 and molecular weight 100.05243 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
oxan-4-one
Also Known As: Tetrahydro-4H-pyran-4-one, 4-Oxotetrahydropyran, oxan-4-one, tetrahydropyran-4-one, DIHYDRO-2H-PYRAN-4(3H)-ONE
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H8O2 |
| Molecular Weight | 100.05243 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.05243 Da |
| Heavy Atoms | 7 |
| Complexity | 70.0 |
| SMILES | C1COCCC1=O |
| InChIKey | JMJRYTGVHCAYCT-UHFFFAOYSA-N |
Chemical Property Profile of Tetrahydro-4H-pyran-4-one
Property Insights of Tetrahydro-4H-pyran-4-one
The XLogP value of -0.5 indicates that Tetrahydro-4H-pyran-4-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 26.3 Ų, Tetrahydro-4H-pyran-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydro-4H-pyran-4-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Tetrahydro-4H-pyran-4-one?
The CAS number of Tetrahydro-4H-pyran-4-one is 29943-42-8.
What is the molecular formula of Tetrahydro-4H-pyran-4-one?
The molecular formula of Tetrahydro-4H-pyran-4-one is C5H8O2.
What is the molecular weight of Tetrahydro-4H-pyran-4-one?
The molecular weight of Tetrahydro-4H-pyran-4-one is 100.05243 g/mol.
Where can I buy Tetrahydro-4H-pyran-4-one?
You can request a quote for Tetrahydro-4H-pyran-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tetrahydro-4H-pyran-4-one?
Yes, CoreyChem provides custom synthesis services for Tetrahydro-4H-pyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.