4-Bromo-3,3,4,4-tetrafluoro-1-butene
TL;DR: 4-Bromo-3,3,4,4-tetrafluoro-1-butene (CAS 18599-22-9) is a chemical compound with molecular formula C4H3BrF4 and molecular weight 205.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-3,3,4,4-tetrafluorobut-1-ene
Also Known As: 4-Bromo-3,3,4,4-tetrafluoro-1-butene, 4-Bromo-3,3,4,4-tetrafluorobut-1-ene, 1-Butene, 4-bromo-3,3,4,4-tetrafluoro-, GVCWGFZDSIWLMO-UHFFFAOYSA-, 2-Vinyl(1-bromoperfluoroethane)
| Molecular Formula | C4H3BrF4 |
|---|---|
| Molecular Weight | 205.94 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.93542 |
| Heavy Atoms | 9 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 18599-22-9 |
|---|---|
| SMILES | C=CC(C(F)(F)Br)(F)F |
| InChIKey | GVCWGFZDSIWLMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromo-3,3,4,4-tetrafluoro-1-butene (CAS 18599-22-9), with molecular formula C4H3BrF4 and molecular weight 205.94 g/mol. IUPAC: 4-bromo-3,3,4,4-tetrafluorobut-1-ene.
Chemical Property Profile of 4-Bromo-3,3,4,4-tetrafluoro-1-butene
Property Insights of 4-Bromo-3,3,4,4-tetrafluoro-1-butene
The XLogP value of 3.0 indicates that 4-Bromo-3,3,4,4-tetrafluoro-1-butene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Bromo-3,3,4,4-tetrafluoro-1-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-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 4-Bromo-3,3,4,4-tetrafluoro-1-butene?
The CAS number of 4-Bromo-3,3,4,4-tetrafluoro-1-butene is 18599-22-9.
What is the molecular formula of 4-Bromo-3,3,4,4-tetrafluoro-1-butene?
The molecular formula of 4-Bromo-3,3,4,4-tetrafluoro-1-butene is C4H3BrF4.
What is the molecular weight of 4-Bromo-3,3,4,4-tetrafluoro-1-butene?
The molecular weight of 4-Bromo-3,3,4,4-tetrafluoro-1-butene is 205.94 g/mol.
Where can I buy 4-Bromo-3,3,4,4-tetrafluoro-1-butene?
You can request a quote for 4-Bromo-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 4-Bromo-3,3,4,4-tetrafluoro-1-butene?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-3,3,4,4-tetrafluoro-1-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.