1-Chloro-1,1,3,3,3-pentafluoro-2-propanone
TL;DR: 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone (CAS 79-53-8) is a chemical compound with molecular formula C3ClF5O and molecular weight 181.95578 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-1,1,3,3,3-pentafluoropropan-2-one
Also Known As: CHLOROPENTAFLUOROACETONE, Pentafluorochloroacetone, C3ClF5O, Pentafluoromonochloroacetone, chlorpentafluoroacetone
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C3ClF5O |
| Molecular Weight | 181.95578 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 181.95578 Da |
| Heavy Atoms | 10 |
| Complexity | 149.0 |
| SMILES | C(=O)(C(F)(F)F)C(F)(F)Cl |
| InChIKey | OJUUDWYPNQALHZ-UHFFFAOYSA-N |
Product Description
Applications: 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone (CAS 79-53-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A organic building block supplied by CoreyChem, 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone (CAS 79-53-8) has the molecular formula C3ClF5O and a molecular weight of 181.96 g/mol. It is also known as CHLOROPENTAFLUOROACETONE and Pentafluorochloroacetone.
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-Chloro-1,1,3,3,3-pentafluoro-2-propanone
Property Insights of 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone. With a topological polar surface area (TPSA) of 17.1 Ų, 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone has 0 hydrogen bond donor(s) and 6 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-Chloro-1,1,3,3,3-pentafluoro-2-propanone?
The CAS number of 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone is 79-53-8.
What is the molecular formula of 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone?
The molecular formula of 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone is C3ClF5O.
What is the molecular weight of 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone?
The molecular weight of 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone is 181.95578 g/mol.
What are the applications of 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone?
1-Chloro-1,1,3,3,3-pentafluoro-2-propanone is used in complex organic molecule assembly across discovery and process chemistry, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone?
You can request a quote for 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone?
Yes, CoreyChem provides custom synthesis services for 1-Chloro-1,1,3,3,3-pentafluoro-2-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.