2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-
TL;DR: 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- (CAS 400-44-2) is a chemical compound with molecular formula C4HClF6 and molecular weight 197.9671 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-1,1,1,4,4,4-hexafluorobut-2-ene
Also Known As: CHFB, C4HClF6, Halothane EP Impurity B, 2-Chloro-1,1,1,4,4,4-hexafluoro-2-butene, 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4HClF6 |
| Molecular Weight | 197.9671 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 197.9671 Da |
| Heavy Atoms | 11 |
| Complexity | 162.0 |
| SMILES | C(=C(C(F)(F)F)Cl)C(F)(F)F |
| InChIKey | JRENXZBKMHPULY-UHFFFAOYSA-N |
Product Description
Applications: 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- (CAS 400-44-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- is a organic building block identified by CAS number 400-44-2 and the molecular formula C4HClF6 and a molecular weight of 197.97 g/mol. It is also known as CHFB and C4HClF6.
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 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-
Property Insights of 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-
The XLogP value of 3.1 indicates that 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- 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 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-?
The CAS number of 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- is 400-44-2.
What is the molecular formula of 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-?
The molecular formula of 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- is C4HClF6.
What is the molecular weight of 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-?
The molecular weight of 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- is 197.9671 g/mol.
What are the applications of 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-?
2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- is used in complex organic molecule assembly across discovery and process chemistry, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-?
You can request a quote for 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro-?
Yes, CoreyChem provides custom synthesis services for 2-Butene,2-chloro-1,1,1,4,4,4-hexafluoro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.