Butopyronoxyl
TL;DR: Butopyronoxyl (CAS 532-34-3) is a chemical compound with molecular formula C12H18O4 and molecular weight 226.12051 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
butyl 2,2-dimethyl-4-oxo-3H-pyran-6-carboxylate
Also Known As: Butopyronoxyl, INDALONE, Dihydropyrone, Indalon, BMOO
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H18O4 |
| Molecular Weight | 226.12051 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.12051 Da |
| Heavy Atoms | 16 |
| Complexity | 315.0 |
| Boiling Point | 256-270 °C @ 760 mm Hg |
| Density | 1.052-1.060 @ 25 °C/25 °C |
| Refractive Index | Index of refraction: 1.4745-1.4755 @ 25 °C/D |
| Solubility | Practically insol in water; miscible with alcohol, chloroform, ether, glacial acetic acid |
| SMILES | CCCCOC(=O)C1=CC(=O)CC(O1)(C)C |
| InChIKey | OKIJSNGRQAOIGZ-UHFFFAOYSA-N |
Product Description
Applications: Butopyronoxyl is used in biotechnology workflows and life-science research, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Butopyronoxyl (CAS 532-34-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A biotechnology compound supplied by CoreyChem, Butopyronoxyl (CAS 532-34-3) has the molecular formula C12H18O4 and a molecular weight of 226.12 g/mol. Reported properties include a density of 1.052-1.060 @ 25 °C/25 °C g/cm³, a solubility: Practically insol in water; miscible with alcohol, chloroform, ether, glacial acetic acid. It is also known as Butopyronoxyl and INDALONE.
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 Butopyronoxyl
Property Insights of Butopyronoxyl
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butopyronoxyl. With a topological polar surface area (TPSA) of 52.6 Ų, Butopyronoxyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butopyronoxyl has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Butopyronoxyl?
The CAS number of Butopyronoxyl is 532-34-3.
What is the molecular formula of Butopyronoxyl?
The molecular formula of Butopyronoxyl is C12H18O4.
What is the molecular weight of Butopyronoxyl?
The molecular weight of Butopyronoxyl is 226.12051 g/mol.
What are the applications of Butopyronoxyl?
Butopyronoxyl is used in biotechnology workflows and life-science research, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Butopyronoxyl (CAS 532-34-3) with custom...
Where can I buy Butopyronoxyl?
You can request a quote for Butopyronoxyl directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butopyronoxyl?
Yes, CoreyChem provides custom synthesis services for Butopyronoxyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.