1,4-Dibromo-2-chloro-1,1,2-trifluorobutane
TL;DR: 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane (CAS 378-13-2) is a chemical compound with molecular formula C4H4Br2ClF3 and molecular weight 301.83 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-dibromo-2-chloro-1,1,2-trifluorobutane
Also Known As: 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane, 2-Chloro-1,4-dibromo-1,1,2-trifluorobutane, RJOGGYLEOPNVJV-UHFFFAOYSA-, Br-CF2-CFCl-CH2-CH2-Br, 1H,1H,5H-Octafluoropentyl acrylate
| Molecular Formula | C4H4Br2ClF3 |
|---|---|
| Molecular Weight | 301.83 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.83203 |
| Heavy Atoms | 10 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 378-13-2 |
|---|---|
| SMILES | C(CBr)C(C(F)(F)Br)(F)Cl |
| InChIKey | RJOGGYLEOPNVJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Dibromo-2-chloro-1,1,2-trifluorobutane (CAS 378-13-2), with molecular formula C4H4Br2ClF3 and molecular weight 301.83 g/mol. IUPAC: 1,4-dibromo-2-chloro-1,1,2-trifluorobutane.
Chemical Property Profile of 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane
Property Insights of 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane
The XLogP value of 3.8 indicates that 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane has 0 hydrogen bond donor(s) and 3 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 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane?
The CAS number of 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane is 378-13-2.
What is the molecular formula of 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane?
The molecular formula of 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane is C4H4Br2ClF3.
What is the molecular weight of 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane?
The molecular weight of 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane is 301.83 g/mol.
Where can I buy 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane?
You can request a quote for 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Dibromo-2-chloro-1,1,2-trifluorobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.