4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene
TL;DR: 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene (CAS 99903-41-0) is a chemical compound with molecular formula C8H9ClF6 and molecular weight 254.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene
Also Known As: 4-chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene, 2-Hexene, 4-chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)-
| Molecular Formula | C8H9ClF6 |
|---|---|
| Molecular Weight | 254.03 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.0297 |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 99903-41-0 |
|---|---|
| SMILES | CC(C)C(C=C(C(F)(F)F)C(F)(F)F)Cl |
| InChIKey | NOGIJOQVYUPNNK-UHFFFAOYSA-N |
Product Overview
4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene (CAS 99903-41-0), with molecular formula C8H9ClF6 and molecular weight 254.03 g/mol. IUPAC: 4-chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene.
Chemical Property Profile of 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene
Property Insights of 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene
The XLogP value of 4.7 indicates that 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene 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-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene has 0 hydrogen bond donor(s) and 6 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-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene?
The CAS number of 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene is 99903-41-0.
What is the molecular formula of 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene?
The molecular formula of 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene is C8H9ClF6.
What is the molecular weight of 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene?
The molecular weight of 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene is 254.03 g/mol.
Where can I buy 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene?
You can request a quote for 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-1,1,1-trifluoro-5-methyl-2-(trifluoromethyl)hex-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.