5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene
TL;DR: 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene (CAS 84100-12-9) is a chemical compound with molecular formula C8H5F9 and molecular weight 272.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,6,7,7,7-hexafluoro-4-(trifluoromethyl)hepta-1,4-diene
Also Known As: 2-(2-Propenyl)perfluoro-2-pentene, EINECS 282-094-5, 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene, 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)hepta-1,4-diene, 1,4-Heptadiene,5,6,6,7,7,7-hexafluoro-4-(trifluoromethyl)-
| Molecular Formula | C8H5F9 |
|---|---|
| Molecular Weight | 272.02 g/mol |
| LogP | 4.546 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.02475 |
| Heavy Atoms | 17 |
| Complexity | 316.868 |
Chemical Identifiers
| CAS Number | 84100-12-9 |
|---|---|
| SMILES | C=CCC(=C(C(C(F)(F)F)(F)F)F)C(F)(F)F |
Product Overview
5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene (CAS 84100-12-9), with molecular formula C8H5F9 and molecular weight 272.02 g/mol. IUPAC: 5,6,6,7,7,7-hexafluoro-4-(trifluoromethyl)hepta-1,4-diene.
Chemical Property Profile of 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene
Property Insights of 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene
The XLogP value of 4.546 indicates that 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene 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 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene?
The CAS number of 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene is 84100-12-9.
What is the molecular formula of 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene?
The molecular formula of 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene is C8H5F9.
What is the molecular weight of 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene?
The molecular weight of 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene is 272.02 g/mol.
Where can I buy 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene?
You can request a quote for 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene?
Yes, KEHONG BIO provides custom synthesis services for 5,6,6,7,7,7-Hexafluoro-4-(trifluoromethyl)-1,4-heptadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.