Triethyl Citrate
TL;DR: Triethyl Citrate (CAS 77-93-0) is a chemical compound with molecular formula C12H20O7 and molecular weight 276.1209 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
triethyl 2-hydroxypropane-1,2,3-tricarboxylate
Also Known As: TRIETHYL CITRATE, Ethyl citrate, Eudraflex, Citroflex 2, Hydragen CAT
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H20O7 |
| Molecular Weight | 276.1209 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 276.1209 Da |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
| Purity | ≥99% |
| Melting Point | -55 °C |
| Boiling Point | 294 °C |
| Density | 1.1369 g/cu cm at 20 °C |
| Flash Point | 155 °C (311 °F) - closed cup |
| Vapor Pressure | 0.00189 [mmHg] |
| Refractive Index | [n]D/20: 1,439-1,441 |
| Solubility | In water, 6.50X10+4 mg/L at room temp |
| SMILES | CCOC(=O)CC(CC(=O)OCC)(C(=O)OCC)O |
| InChIKey | DOOTYTYQINUNNV-UHFFFAOYSA-N |
Product Description
Applications: Triethyl Citrate is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Typical specifications: commercial lots are supplied at ≥99%. CoreyChem supplies Triethyl Citrate (CAS 77-93-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Triethyl Citrate (CAS 77-93-0) has the molecular formula C12H20O7 and a molecular weight of 276.12 g/mol. Reported properties include a density of 1.1369 g/cu cm at 20 °C g/cm³, a solubility: In water, 6.50X10+4 mg/L at room temp. It is also known as TRIETHYL CITRATE and Ethyl citrate.
CoreyChem provides it with COA documentation, and custom synthesis from milligram to multi-kilogram scales is available on request. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Triethyl Citrate
Property Insights of Triethyl Citrate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triethyl Citrate. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethyl Citrate. Following Lipinski's Rule of Five, Triethyl Citrate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Triethyl Citrate?
The CAS number of Triethyl Citrate is 77-93-0.
What is the molecular formula of Triethyl Citrate?
The molecular formula of Triethyl Citrate is C12H20O7.
What is the molecular weight of Triethyl Citrate?
The molecular weight of Triethyl Citrate is 276.1209 g/mol.
What are the applications of Triethyl Citrate?
Triethyl Citrate is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Typical specifications: commercial lots are supplied at ≥99%. CoreyChem...
Where can I buy Triethyl Citrate?
You can request a quote for Triethyl Citrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Triethyl Citrate?
Yes, CoreyChem provides custom synthesis services for Triethyl Citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.