CTK5I5942
TL;DR: CTK5I5942 (CAS 232267-33-3) is a chemical compound with molecular formula C6H2BrF9 and molecular weight 323.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4,4,4-trifluoro-3,3-bis(trifluoromethyl)but-1-ene
Also Known As: 1-Bromo-4,4,4-trifluoro-3,3-bis(trifluoromethyl)but-1-ene
| Molecular Formula | C6H2BrF9 |
|---|---|
| Molecular Weight | 323.92 g/mol |
| LogP | 4.5683 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 323.91962 |
| Heavy Atoms | 16 |
| Complexity | 231.15538 |
Chemical Identifiers
| CAS Number | 232267-33-3 |
|---|---|
| SMILES | C(=CBr)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F |
Product Overview
CTK5I5942 (CAS 232267-33-3), with molecular formula C6H2BrF9 and molecular weight 323.92 g/mol. IUPAC: 1-bromo-4,4,4-trifluoro-3,3-bis(trifluoromethyl)but-1-ene.
Chemical Property Profile of CTK5I5942
Property Insights of CTK5I5942
The XLogP value of 4.5683 indicates that CTK5I5942 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, CTK5I5942 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK5I5942 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 CTK5I5942?
The CAS number of CTK5I5942 is 232267-33-3.
What is the molecular formula of CTK5I5942?
The molecular formula of CTK5I5942 is C6H2BrF9.
What is the molecular weight of CTK5I5942?
The molecular weight of CTK5I5942 is 323.92 g/mol.
Where can I buy CTK5I5942?
You can request a quote for CTK5I5942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK5I5942?
Yes, KEHONG BIO provides custom synthesis services for CTK5I5942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.