4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one
TL;DR: 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one (CAS 53602-00-9) is a chemical compound with molecular formula C6H8N2O2 and molecular weight 140.05858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridin-3-one
Also Known As: THPO, 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3-ol, 4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridin-3(2H)-one, 4,5,6,7-tetrahydro-[1,2]oxazolo[4,5-c]pyridin-3-one, 4,5,6,7-Tetrahydroisoxazolo[4,5-c]pyridin-3-ol
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H8N2O2 |
| Molecular Weight | 140.05858 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.05858 Da |
| Heavy Atoms | 10 |
| Complexity | 210.0 |
| SMILES | C1CNCC2=C1ONC2=O |
| InChIKey | SXXLKZCNJHJYFL-UHFFFAOYSA-N |
Product Description
Applications: 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one (CAS 53602-00-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one is a pharmaceutical intermediate identified by CAS number 53602-00-9 and the molecular formula C6H8N2O2 and a molecular weight of 140.06 g/mol. It is also known as THPO and 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3-ol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one
Property Insights of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one
The XLogP value of -0.9 indicates that 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 50.4 Ų, 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one?
The CAS number of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one is 53602-00-9.
What is the molecular formula of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one?
The molecular formula of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one is C6H8N2O2.
What is the molecular weight of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one?
The molecular weight of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one is 140.05858 g/mol.
What are the applications of 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one?
4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one?
You can request a quote for 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one?
Yes, CoreyChem provides custom synthesis services for 4,5,6,7-Tetrahydroisoxazolo(4,5-c)pyridin-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.