碳酸二乙酯
TL;DR: 碳酸二乙酯 (CAS 105-58-8) is a chemical compound with molecular formula C5H10O3 and molecular weight 118.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
碳酸二乙酯
diethyl carbonate
Also Known As: DIETHYL CARBONATE, Ethyl carbonate, Eufin, Diatol, Carbonic ether
| Molecular Formula | C5H10O3 |
|---|---|
| Molecular Weight | 118.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 118.062996 |
| Heavy Atoms | 8 |
| Complexity | 62.0 |
| Melting Point | -42.8 °C |
| Boiling Point | 126.1 °C at 760 mmHg |
| Density | 0.975 at 20.0 °C - Less dense than water; will float |
| Solubility | Insoluble (NTP, 1992) |
| Flash Point | 25.0 °C |
| Vapor Pressure | 10 mmHg at 23.8 °C |
| Refractive Index | 1.3845 @ 20 °C; Sadtler ref number: 8024 (IR, prism); 290 (NMR) |
Chemical Identifiers
| CAS Number | 105-58-8 |
|---|---|
| SMILES | CCOC(=O)OCC |
| InChIKey | OIFBSDVPJOWBCH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
碳酸二乙酯 (CAS 105-58-8), with molecular formula C5H10O3 and molecular weight 118.06 g/mol. IUPAC: diethyl carbonate.
Chemical Property Profile of 碳酸二乙酯
Property Insights of 碳酸二乙酯
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 碳酸二乙酯. With a topological polar surface area (TPSA) of 35.5 Ų, 碳酸二乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 碳酸二乙酯 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
Frequently Asked Questions
What is the CAS number of 碳酸二乙酯?
The CAS number of 碳酸二乙酯 is 105-58-8.
What is the molecular formula of 碳酸二乙酯?
The molecular formula of 碳酸二乙酯 is C5H10O3.
What is the molecular weight of 碳酸二乙酯?
The molecular weight of 碳酸二乙酯 is 118.06 g/mol.
Where can I buy 碳酸二乙酯?
You can request a quote for 碳酸二乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 碳酸二乙酯?
Yes, KEHONG BIO provides custom synthesis services for 碳酸二乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.