Trichloroethanol
TL;DR: Trichloroethanol (CAS 115-20-8) is a chemical compound with molecular formula C2H3Cl3O and molecular weight 147.92494 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2,2-trichloroethanol
Also Known As: 2,2,2-TRICHLOROETHANOL, Trichloroethanol, Trichlorethanol, Trichloroethyl alcohol, Ethanol, 2,2,2-trichloro-
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C2H3Cl3O |
| Molecular Weight | 147.92494 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.92494 Da |
| Heavy Atoms | 6 |
| Complexity | 38.0 |
| Melting Point | 19 °C |
| Boiling Point | 150 °C @760 [mm Hg] |
| Density | 1.54 @25 °C |
| Vapor Pressure | 1.08 [mmHg] |
| Solubility | 83.3 mg/mL at 25 °C |
| SMILES | C(C(Cl)(Cl)Cl)O |
| InChIKey | KPWDGTGXUYRARH-UHFFFAOYSA-N |
Product Description
Applications: Trichloroethanol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Trichloroethanol (CAS 115-20-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, Trichloroethanol (CAS 115-20-8) has the molecular formula C2H3Cl3O and a molecular weight of 147.92 g/mol. Reported properties include a density of 1.54 @25 °C g/cm³, a solubility: 83.3 mg/mL at 25 °C. It is also known as 2,2,2-TRICHLOROETHANOL and Trichloroethanol.
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 Trichloroethanol
Property Insights of Trichloroethanol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trichloroethanol. With a topological polar surface area (TPSA) of 20.2 Ų, Trichloroethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trichloroethanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Trichloroethanol?
The CAS number of Trichloroethanol is 115-20-8.
What is the molecular formula of Trichloroethanol?
The molecular formula of Trichloroethanol is C2H3Cl3O.
What is the molecular weight of Trichloroethanol?
The molecular weight of Trichloroethanol is 147.92494 g/mol.
What are the applications of Trichloroethanol?
Trichloroethanol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Trichloroethanol (CAS 115-20-8) with...
Where can I buy Trichloroethanol?
You can request a quote for Trichloroethanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Trichloroethanol?
Yes, CoreyChem provides custom synthesis services for Trichloroethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.