Ethadione
TL;DR: Ethadione (CAS 520-77-4) is a chemical compound with molecular formula C7H11NO3 and molecular weight 157.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethyl-5,5-dimethyl-1,3-oxazolidine-2,4-dione
Also Known As: ETHADIONE, Petisan, Epinyl, Ethadionum, Neo-Absentol
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H11NO3 |
| Molecular Weight | 157.0739 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.0739 Da |
| Heavy Atoms | 11 |
| Complexity | 210.0 |
| SMILES | CCN1C(=O)C(OC1=O)(C)C |
| InChIKey | SIGSNYAYBSJATD-UHFFFAOYSA-N |
Product Description
Applications: Ethadione is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Ethadione is a pharmaceutical intermediate identified by CAS number 520-77-4 and the molecular formula C7H11NO3 and a molecular weight of 157.07 g/mol. Synonyms include ETHADIONE and Petisan.
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 Ethadione
Property Insights of Ethadione
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethadione. With a topological polar surface area (TPSA) of 46.6 Ų, Ethadione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethadione 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
What is the CAS number of Ethadione?
The CAS number of Ethadione is 520-77-4.
What is the molecular formula of Ethadione?
The molecular formula of Ethadione is C7H11NO3.
What is the molecular weight of Ethadione?
The molecular weight of Ethadione is 157.0739 g/mol.
What are the applications of Ethadione?
Ethadione is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Ethadione?
You can request a quote for Ethadione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethadione?
Yes, CoreyChem provides custom synthesis services for Ethadione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.