Dimethadione
TL;DR: Dimethadione (CAS 695-53-4) is a chemical compound with molecular formula C5H7NO3 and molecular weight 129.04259 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,5-dimethyl-1,3-oxazolidine-2,4-dione
Also Known As: dimethadione, 5,5-Dimethyloxazolidine-2,4-dione, Eupractone, Dimethadion, Propazone
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H7NO3 |
| Molecular Weight | 129.04259 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 129.04259 Da |
| Heavy Atoms | 9 |
| Complexity | 173.0 |
| SMILES | CC1(C(=O)NC(=O)O1)C |
| InChIKey | JYJFNDQBESEHJQ-UHFFFAOYSA-N |
Product Description
Applications: Dimethadione 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).
A pharmaceutical intermediate supplied by CoreyChem, Dimethadione (CAS 695-53-4) has the molecular formula C5H7NO3 and a molecular weight of 129.04 g/mol. Synonyms include dimethadione and 5,5-Dimethyloxazolidine-2,4-dione.
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 Dimethadione
Property Insights of Dimethadione
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethadione. With a topological polar surface area (TPSA) of 55.4 Ų, Dimethadione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethadione has 1 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 Dimethadione?
The CAS number of Dimethadione is 695-53-4.
What is the molecular formula of Dimethadione?
The molecular formula of Dimethadione is C5H7NO3.
What is the molecular weight of Dimethadione?
The molecular weight of Dimethadione is 129.04259 g/mol.
What are the applications of Dimethadione?
Dimethadione 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 Dimethadione?
You can request a quote for Dimethadione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethadione?
Yes, CoreyChem provides custom synthesis services for Dimethadione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.