3,3,4,4-Tetrafluoro-1-butene
TL;DR: 3,3,4,4-Tetrafluoro-1-butene (CAS 40723-71-5) is a chemical compound with molecular formula C4H4F4 and molecular weight 128.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,4,4-tetrafluorobut-1-ene
Also Known As: tetrafluorobutene, 3,3,4,4-tetrafluorobut-1-ene, 3,3,4,4-Tetrafluoro-1-butene, 1-Butene,3,3,4,4-tetrafluoro-, 1-Butene, 3,3,4,4-tetrafluoro-
| Molecular Formula | C4H4F4 |
|---|---|
| Molecular Weight | 128.02 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 128.02492 |
| Heavy Atoms | 8 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 40723-71-5 |
|---|---|
| SMILES | C=CC(C(F)F)(F)F |
| InChIKey | BNLLWAALHYCOQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3,4,4-Tetrafluoro-1-butene (CAS 40723-71-5), with molecular formula C4H4F4 and molecular weight 128.02 g/mol. IUPAC: 3,3,4,4-tetrafluorobut-1-ene.
Chemical Property Profile of 3,3,4,4-Tetrafluoro-1-butene
Property Insights of 3,3,4,4-Tetrafluoro-1-butene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,4,4-Tetrafluoro-1-butene. With a topological polar surface area (TPSA) of 0.0 Ų, 3,3,4,4-Tetrafluoro-1-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,4,4-Tetrafluoro-1-butene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3,4,4-Tetrafluoro-1-butene?
The CAS number of 3,3,4,4-Tetrafluoro-1-butene is 40723-71-5.
What is the molecular formula of 3,3,4,4-Tetrafluoro-1-butene?
The molecular formula of 3,3,4,4-Tetrafluoro-1-butene is C4H4F4.
What is the molecular weight of 3,3,4,4-Tetrafluoro-1-butene?
The molecular weight of 3,3,4,4-Tetrafluoro-1-butene is 128.02 g/mol.
Where can I buy 3,3,4,4-Tetrafluoro-1-butene?
You can request a quote for 3,3,4,4-Tetrafluoro-1-butene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,4,4-Tetrafluoro-1-butene?
Yes, KEHONG BIO provides custom synthesis services for 3,3,4,4-Tetrafluoro-1-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.