1,1,1-Trifluoro-2-propanol
TL;DR: 1,1,1-Trifluoro-2-propanol (CAS 374-01-6) is a chemical compound with molecular formula C3H5F3O and molecular weight 114.02925 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,1,1-trifluoropropan-2-ol
Also Known As: 1,1,1-Trifluoropropan-2-ol, 1,1,1-TRIFLUORO-2-PROPANOL, 2-Propanol, 1,1,1-trifluoro-, 1,1,1-Trifluoroisopropanol, 1,1,1-trifluoro-propan-2-ol
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3H5F3O |
| Molecular Weight | 114.02925 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 114.02925 Da |
| Heavy Atoms | 7 |
| Complexity | 57.0 |
| Vapor Pressure | 60.9 [mmHg] |
| SMILES | CC(C(F)(F)F)O |
| InChIKey | GILIYJDBJZWGBG-UHFFFAOYSA-N |
Product Description
Applications: 1,1,1-Trifluoro-2-propanol 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 1,1,1-Trifluoro-2-propanol (CAS 374-01-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
1,1,1-Trifluoro-2-propanol (CAS 374-01-6) is a pharmaceutical intermediate with the molecular formula C3H5F3O and a molecular weight of 114.03 g/mol. It is also known as 1,1,1-Trifluoropropan-2-ol and 1,1,1-TRIFLUORO-2-PROPANOL.
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 1,1,1-Trifluoro-2-propanol
Property Insights of 1,1,1-Trifluoro-2-propanol
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,1,1-Trifluoro-2-propanol. With a topological polar surface area (TPSA) of 20.2 Ų, 1,1,1-Trifluoro-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1-Trifluoro-2-propanol has 1 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 1,1,1-Trifluoro-2-propanol?
The CAS number of 1,1,1-Trifluoro-2-propanol is 374-01-6.
What is the molecular formula of 1,1,1-Trifluoro-2-propanol?
The molecular formula of 1,1,1-Trifluoro-2-propanol is C3H5F3O.
What is the molecular weight of 1,1,1-Trifluoro-2-propanol?
The molecular weight of 1,1,1-Trifluoro-2-propanol is 114.02925 g/mol.
What are the applications of 1,1,1-Trifluoro-2-propanol?
1,1,1-Trifluoro-2-propanol 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 1,1,1-Trifluoro-2-propanol...
Where can I buy 1,1,1-Trifluoro-2-propanol?
You can request a quote for 1,1,1-Trifluoro-2-propanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1,1-Trifluoro-2-propanol?
Yes, CoreyChem provides custom synthesis services for 1,1,1-Trifluoro-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.