1,1,1,2,2-Pentafluorohexane
TL;DR: 1,1,1,2,2-Pentafluorohexane (CAS 99697-24-2) is a chemical compound with molecular formula CCCCC(C(F)(F)F)(F)F and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,2,2-pentafluorohexane
Also Known As: 1,1,1,2,2-Pentafluorohexane, Hexane, 1,1,1,2,2-pentafluoro-, RefChem:70821
| Molecular Formula | CCCCC(C(F)(F)F)(F)F |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.06244 |
| Heavy Atoms | 11 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 99697-24-2 |
|---|---|
| SMILES | CCCCC(C(F)(F)F)(F)F |
| InChIKey | YVTUKCQAIFPUQE-UHFFFAOYSA-N |
Product Overview
1,1,1,2,2-Pentafluorohexane (CAS 99697-24-2), with molecular formula CCCCC(C(F)(F)F)(F)F and molecular weight 176.06 g/mol. IUPAC: 1,1,1,2,2-pentafluorohexane.
Chemical Property Profile of 1,1,1,2,2-Pentafluorohexane
Property Insights of 1,1,1,2,2-Pentafluorohexane
The XLogP value of 3.8 indicates that 1,1,1,2,2-Pentafluorohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,1,2,2-Pentafluorohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,2,2-Pentafluorohexane has 0 hydrogen bond donor(s) and 5 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 1,1,1,2,2-Pentafluorohexane?
The CAS number of 1,1,1,2,2-Pentafluorohexane is 99697-24-2.
What is the molecular formula of 1,1,1,2,2-Pentafluorohexane?
The molecular formula of 1,1,1,2,2-Pentafluorohexane is CCCCC(C(F)(F)F)(F)F.
What is the molecular weight of 1,1,1,2,2-Pentafluorohexane?
The molecular weight of 1,1,1,2,2-Pentafluorohexane is 176.06 g/mol.
Where can I buy 1,1,1,2,2-Pentafluorohexane?
You can request a quote for 1,1,1,2,2-Pentafluorohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,1,2,2-Pentafluorohexane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,2,2-Pentafluorohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.