1,1,1,2,2-Pentafluoro-4-iodobutane
TL;DR: 1,1,1,2,2-Pentafluoro-4-iodobutane (CAS 40723-80-6) is a chemical compound with molecular formula C4H4F5I and molecular weight 273.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,1,2,2-pentafluoro-4-iodobutane
Also Known As: 1,1,1,2,2-Pentafluoro-4-iodobutane, 4-iodo-1,1,1,2,2-pentafluorobutane, 2:2 Fluorotelomer iodide, perfluoroethylethyl iodide, Butane, 1,1,1,2,2-pentafluoro-4-iodo-
| Molecular Formula | C4H4F5I |
|---|---|
| Molecular Weight | 273.93 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.9278 |
| Heavy Atoms | 10 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 40723-80-6 |
|---|---|
| SMILES | C(CI)C(C(F)(F)F)(F)F |
| InChIKey | PPXVPFPTMXFUDE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,1,2,2-Pentafluoro-4-iodobutane (CAS 40723-80-6), with molecular formula C4H4F5I and molecular weight 273.93 g/mol. IUPAC: 1,1,1,2,2-pentafluoro-4-iodobutane.
Chemical Property Profile of 1,1,1,2,2-Pentafluoro-4-iodobutane
Property Insights of 1,1,1,2,2-Pentafluoro-4-iodobutane
The XLogP value of 3.5 indicates that 1,1,1,2,2-Pentafluoro-4-iodobutane 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-Pentafluoro-4-iodobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,1,2,2-Pentafluoro-4-iodobutane 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-Pentafluoro-4-iodobutane?
The CAS number of 1,1,1,2,2-Pentafluoro-4-iodobutane is 40723-80-6.
What is the molecular formula of 1,1,1,2,2-Pentafluoro-4-iodobutane?
The molecular formula of 1,1,1,2,2-Pentafluoro-4-iodobutane is C4H4F5I.
What is the molecular weight of 1,1,1,2,2-Pentafluoro-4-iodobutane?
The molecular weight of 1,1,1,2,2-Pentafluoro-4-iodobutane is 273.93 g/mol.
Where can I buy 1,1,1,2,2-Pentafluoro-4-iodobutane?
You can request a quote for 1,1,1,2,2-Pentafluoro-4-iodobutane 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-Pentafluoro-4-iodobutane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,1,2,2-Pentafluoro-4-iodobutane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.