Diethyl Sulfate
TL;DR: Diethyl Sulfate (CAS 64-67-5) is a chemical compound with molecular formula C4H10O4S and molecular weight 154.02998 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
硫酸二乙酯
diethyl sulfate
Also Known As: Diethyl sulfate, Diethyl sulphate, Ethyl sulfate, Diaethylsulfat, DIETHYLSULFATE
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H10O4S |
| Molecular Weight | 154.02998 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.02998 Da |
| Heavy Atoms | 9 |
| Complexity | 130.0 |
| Melting Point | -12 °F (USCG, 1999) |
| Boiling Point | 409 °F at 760 mmHg (USCG, 1999) |
| Density | 1.1803 at 68 °F (USCG, 1999) - Denser than water; will sink |
| Flash Point | 220 °F (USCG, 1999) |
| Vapor Pressure | 0.21 [mmHg] |
| Refractive Index | Index of Refraction = 1.40037 @ 20 °C/D |
| Solubility | Miscible in alcohol and ether. |
| SMILES | CCOS(=O)(=O)OCC |
| InChIKey | DENRZWYUOJLTMF-UHFFFAOYSA-N |
Product Description
Applications: Diethyl Sulfate 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. CoreyChem supplies Diethyl Sulfate (CAS 64-67-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Diethyl Sulfate (CAS 64-67-5) is a pharmaceutical intermediate with the molecular formula C4H10O4S and a molecular weight of 154.03 g/mol. Key physical properties include a density of 1.1803 at 68 °F (USCG, 1999) - Denser than water; will sink g/cm³, a solubility: Miscible in alcohol and ether. It is also known as Diethyl sulfate and Diethyl sulphate.
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 Diethyl Sulfate
Property Insights of Diethyl Sulfate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl Sulfate. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl Sulfate. Following Lipinski's Rule of Five, Diethyl Sulfate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Diethyl Sulfate?
The CAS number of Diethyl Sulfate is 64-67-5.
What is the molecular formula of Diethyl Sulfate?
The molecular formula of Diethyl Sulfate is C4H10O4S.
What is the molecular weight of Diethyl Sulfate?
The molecular weight of Diethyl Sulfate is 154.02998 g/mol.
What are the applications of Diethyl Sulfate?
Diethyl Sulfate 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. CoreyChem supplies Diethyl Sulfate (CAS 64-67-5) with...
Where can I buy Diethyl Sulfate?
You can request a quote for Diethyl Sulfate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethyl Sulfate?
Yes, CoreyChem provides custom synthesis services for Diethyl Sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.