二甲双酮
TL;DR: 二甲双酮 (CAS 695-53-4) is a chemical compound with molecular formula C5H7NO3 and molecular weight 129.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二甲双酮
5,5-dimethyl-1,3-oxazolidine-2,4-dione
Also Known As: dimethadione, 5,5-Dimethyloxazolidine-2,4-dione, Eupractone, Dimethadion, Propazone
| Molecular Formula | C5H7NO3 |
|---|---|
| Molecular Weight | 129.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 129.04259 |
| Heavy Atoms | 9 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 695-53-4 |
|---|---|
| SMILES | CC1(C(=O)NC(=O)O1)C |
| InChIKey | JYJFNDQBESEHJQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二甲双酮 (CAS 695-53-4), with molecular formula C5H7NO3 and molecular weight 129.04 g/mol. IUPAC: 5,5-dimethyl-1,3-oxazolidine-2,4-dione.
Chemical Property Profile of 二甲双酮
Property Insights of 二甲双酮
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二甲双酮. With a topological polar surface area (TPSA) of 55.4 Ų, 二甲双酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二甲双酮 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
Frequently Asked Questions
What is the CAS number of 二甲双酮?
The CAS number of 二甲双酮 is 695-53-4.
What is the molecular formula of 二甲双酮?
The molecular formula of 二甲双酮 is C5H7NO3.
What is the molecular weight of 二甲双酮?
The molecular weight of 二甲双酮 is 129.04 g/mol.
Where can I buy 二甲双酮?
You can request a quote for 二甲双酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二甲双酮?
Yes, KEHONG BIO provides custom synthesis services for 二甲双酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.