1,3-Dibromo-1,1-difluorobutane
TL;DR: 1,3-Dibromo-1,1-difluorobutane (CAS 406-42-8) is a chemical compound with molecular formula C4H6Br2F2 and molecular weight 249.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dibromo-1,1-difluorobutane
Also Known As: 1,3-dibromo-1,1-difluorobutane, 1,3-dibromo-1,1-difluoro-butane, Butane,1,3-dibromo-1,1-difluoro-, 1,3-Dibromo-1,1-difluorobutane, tech., RefChem:218373
| Molecular Formula | C4H6Br2F2 |
|---|---|
| Molecular Weight | 249.88 g/mol |
| LogP | 3.1476 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.88043 |
| Heavy Atoms | 8 |
| Complexity | 66.92879 |
Chemical Identifiers
| CAS Number | 406-42-8 |
|---|---|
| SMILES | CC(CC(F)(F)Br)Br |
Product Overview
1,3-Dibromo-1,1-difluorobutane (CAS 406-42-8), with molecular formula C4H6Br2F2 and molecular weight 249.88 g/mol. IUPAC: 1,3-dibromo-1,1-difluorobutane.
Chemical Property Profile of 1,3-Dibromo-1,1-difluorobutane
Property Insights of 1,3-Dibromo-1,1-difluorobutane
The XLogP value of 3.1476 indicates that 1,3-Dibromo-1,1-difluorobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,3-Dibromo-1,1-difluorobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dibromo-1,1-difluorobutane has 0 hydrogen bond donor(s) and 0 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 1,3-Dibromo-1,1-difluorobutane?
The CAS number of 1,3-Dibromo-1,1-difluorobutane is 406-42-8.
What is the molecular formula of 1,3-Dibromo-1,1-difluorobutane?
The molecular formula of 1,3-Dibromo-1,1-difluorobutane is C4H6Br2F2.
What is the molecular weight of 1,3-Dibromo-1,1-difluorobutane?
The molecular weight of 1,3-Dibromo-1,1-difluorobutane is 249.88 g/mol.
Where can I buy 1,3-Dibromo-1,1-difluorobutane?
You can request a quote for 1,3-Dibromo-1,1-difluorobutane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dibromo-1,1-difluorobutane?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dibromo-1,1-difluorobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.