Heptafluorobenzyl iodide
TL;DR: Heptafluorobenzyl iodide (CAS 79865-03-5) is a chemical compound with molecular formula C7F7I and molecular weight 343.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[difluoro(iodo)methyl]-2,3,4,5,6-pentafluorobenzene
Also Known As: Heptafluorobenzyl iodide, Heptafluorobenzyliodide, perfluorobenzyl iodide, 1-[Difluoro(iodo)methyl]-2,3,4,5,6-pentafluorobenzene, Heptafluorobenzyl iodide 100g
| Molecular Formula | C7F7I |
|---|---|
| Molecular Weight | 343.89 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 343.89328 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 79865-03-5 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1F)F)F)F)F)C(F)(F)I |
| InChIKey | KBTGPFZDZIZYLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptafluorobenzyl iodide (CAS 79865-03-5), with molecular formula C7F7I and molecular weight 343.89 g/mol. IUPAC: 1-[difluoro(iodo)methyl]-2,3,4,5,6-pentafluorobenzene.
Chemical Property Profile of Heptafluorobenzyl iodide
Property Insights of Heptafluorobenzyl iodide
The XLogP value of 3.6 indicates that Heptafluorobenzyl iodide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Heptafluorobenzyl iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptafluorobenzyl iodide has 0 hydrogen bond donor(s) and 7 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 Heptafluorobenzyl iodide?
The CAS number of Heptafluorobenzyl iodide is 79865-03-5.
What is the molecular formula of Heptafluorobenzyl iodide?
The molecular formula of Heptafluorobenzyl iodide is C7F7I.
What is the molecular weight of Heptafluorobenzyl iodide?
The molecular weight of Heptafluorobenzyl iodide is 343.89 g/mol.
Where can I buy Heptafluorobenzyl iodide?
You can request a quote for Heptafluorobenzyl iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptafluorobenzyl iodide?
Yes, KEHONG BIO provides custom synthesis services for Heptafluorobenzyl iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.