酮基泛酰内酯
TL;DR: 酮基泛酰内酯 (CAS 13031-04-4) is a chemical compound with molecular formula C6H8O3 and molecular weight 128.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
酮基泛酰内酯
4,4-dimethyloxolane-2,3-dione
Also Known As: Keto-pantoyllactone, ketopantolactone, 4,4-Dimethyldihydrofuran-2,3-dione, 2-dehydropantolactone, Dihydro-4,4-dimethyl-2,3-Furandione
| Molecular Formula | C6H8O3 |
|---|---|
| Molecular Weight | 128.05 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.04735 |
| Heavy Atoms | 9 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 13031-04-4 |
|---|---|
| SMILES | CC1(COC(=O)C1=O)C |
| InChIKey | HRTOQFBQOFIFEE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
酮基泛酰内酯 (CAS 13031-04-4), with molecular formula C6H8O3 and molecular weight 128.05 g/mol. IUPAC: 4,4-dimethyloxolane-2,3-dione.
Chemical Property Profile of 酮基泛酰内酯
Property Insights of 酮基泛酰内酯
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 酮基泛酰内酯. With a topological polar surface area (TPSA) of 43.4 Ų, 酮基泛酰内酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 酮基泛酰内酯 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 酮基泛酰内酯?
The CAS number of 酮基泛酰内酯 is 13031-04-4.
What is the molecular formula of 酮基泛酰内酯?
The molecular formula of 酮基泛酰内酯 is C6H8O3.
What is the molecular weight of 酮基泛酰内酯?
The molecular weight of 酮基泛酰内酯 is 128.05 g/mol.
Where can I buy 酮基泛酰内酯?
You can request a quote for 酮基泛酰内酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 酮基泛酰内酯?
Yes, KEHONG BIO provides custom synthesis services for 酮基泛酰内酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.