3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne
TL;DR: 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne (CAS 261503-79-1) is a chemical compound with molecular formula C6HF9 and molecular weight 243.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-yne
Also Known As: 3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-yne, 3,4,4,5,5,5-Hexafluoro-3-trifluoromethyl-1-pentyne, 3,4,4,5,5,5-Hexafluoro-3-trifluoromethylpent-1-yne
| Molecular Formula | C6HF9 |
|---|---|
| Molecular Weight | 243.99 g/mol |
| LogP | 3.0878 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.99345 |
| Heavy Atoms | 15 |
| Complexity | 276.44836 |
Chemical Identifiers
| CAS Number | 261503-79-1 |
|---|---|
| SMILES | C#CC(C(C(F)(F)F)(F)F)(C(F)(F)F)F |
Product Overview
3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne (CAS 261503-79-1), with molecular formula C6HF9 and molecular weight 243.99 g/mol. IUPAC: 3,4,4,5,5,5-hexafluoro-3-(trifluoromethyl)pent-1-yne.
Chemical Property Profile of 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne
Property Insights of 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne
The XLogP value of 3.0878 indicates that 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne 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 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne?
The CAS number of 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne is 261503-79-1.
What is the molecular formula of 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne?
The molecular formula of 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne is C6HF9.
What is the molecular weight of 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne?
The molecular weight of 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne is 243.99 g/mol.
Where can I buy 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne?
You can request a quote for 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne?
Yes, KEHONG BIO provides custom synthesis services for 3,4,4,5,5,5-Hexafluoro-3-(trifluoromethyl)pent-1-yne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.