1,3-Dichloro-5,5-dimethylhydantoin
TL;DR: 1,3-Dichloro-5,5-dimethylhydantoin (CAS 118-52-5) is a chemical compound with molecular formula C5H6Cl2N2O2 and molecular weight 195.98064 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dichloro-5,5-dimethylimidazolidine-2,4-dione
Also Known As: 1,3-DICHLORO-5,5-DIMETHYLHYDANTOIN, Dantoin, Dactin, Halane, Daktin
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H6Cl2N2O2 |
| Molecular Weight | 195.98064 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 195.98064 Da |
| Heavy Atoms | 11 |
| Complexity | 229.0 |
| Melting Point | 270 °F (NTP, 1992) |
| Boiling Point | Sublimes at 212 °F (NTP, 1992) |
| Density | 1.5 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 346 °F (NIOSH, 2024) |
| Vapor Pressure | 0.000024 [mmHg] |
| Solubility | Reaction (NTP, 1992) |
| SMILES | CC1(C(=O)N(C(=O)N1Cl)Cl)C |
| InChIKey | KEQGZUUPPQEDPF-UHFFFAOYSA-N |
Product Description
Applications: 1,3-Dichloro-5,5-dimethylhydantoin is used in surfactant and detergent formulations, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1,3-Dichloro-5,5-dimethylhydantoin (CAS 118-52-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A surfactant raw material supplied by CoreyChem, 1,3-Dichloro-5,5-dimethylhydantoin (CAS 118-52-5) has the molecular formula C5H6Cl2N2O2 and a molecular weight of 195.98 g/mol. Reported properties include a density of 1.5 at 68 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: Reaction (NTP, 1992). It is also known as 1,3-DICHLORO-5,5-DIMETHYLHYDANTOIN and Dantoin.
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 1,3-Dichloro-5,5-dimethylhydantoin
Property Insights of 1,3-Dichloro-5,5-dimethylhydantoin
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dichloro-5,5-dimethylhydantoin. With a topological polar surface area (TPSA) of 40.6 Ų, 1,3-Dichloro-5,5-dimethylhydantoin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichloro-5,5-dimethylhydantoin has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1,3-Dichloro-5,5-dimethylhydantoin?
The CAS number of 1,3-Dichloro-5,5-dimethylhydantoin is 118-52-5.
What is the molecular formula of 1,3-Dichloro-5,5-dimethylhydantoin?
The molecular formula of 1,3-Dichloro-5,5-dimethylhydantoin is C5H6Cl2N2O2.
What is the molecular weight of 1,3-Dichloro-5,5-dimethylhydantoin?
The molecular weight of 1,3-Dichloro-5,5-dimethylhydantoin is 195.98064 g/mol.
What are the applications of 1,3-Dichloro-5,5-dimethylhydantoin?
1,3-Dichloro-5,5-dimethylhydantoin is used in surfactant and detergent formulations, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 1,3-Dichloro-5,5-dimethylhydantoin?
You can request a quote for 1,3-Dichloro-5,5-dimethylhydantoin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Dichloro-5,5-dimethylhydantoin?
Yes, CoreyChem provides custom synthesis services for 1,3-Dichloro-5,5-dimethylhydantoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.