Pentafluoro-(iodomethyl)benzene
TL;DR: Pentafluoro-(iodomethyl)benzene (CAS 111196-50-0) is a chemical compound with molecular formula C7H2F5I and molecular weight 307.91214 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4,5-pentafluoro-6-(iodomethyl)benzene
Also Known As: Pentafluoro-(iodomethyl)benzene, pentafluorobenzyl iodide, PENTAFLUORO(IODOMETHYL)-BENZENE, 1,2,3,4,5-pentafluoro-6-(iodomethyl)benzene, PENTAFLUORO(IODOMETHYL)BENZENE
Technical Specifications
| Molecular Formula | C7H2F5I |
| Molecular Weight | 307.91214 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 307.91214 Da |
| Heavy Atoms | 13 |
| Complexity | 162.0 |
| SMILES | C(C1=C(C(=C(C(=C1F)F)F)F)F)I |
| InChIKey | AQKQNUNUFNYQFB-UHFFFAOYSA-N |
Chemical Property Profile of Pentafluoro-(iodomethyl)benzene
Property Insights of Pentafluoro-(iodomethyl)benzene
The XLogP value of 3.4 indicates that Pentafluoro-(iodomethyl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Pentafluoro-(iodomethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentafluoro-(iodomethyl)benzene 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
What is the CAS number of Pentafluoro-(iodomethyl)benzene?
The CAS number of Pentafluoro-(iodomethyl)benzene is 111196-50-0.
What is the molecular formula of Pentafluoro-(iodomethyl)benzene?
The molecular formula of Pentafluoro-(iodomethyl)benzene is C7H2F5I.
What is the molecular weight of Pentafluoro-(iodomethyl)benzene?
The molecular weight of Pentafluoro-(iodomethyl)benzene is 307.91214 g/mol.
Where can I buy Pentafluoro-(iodomethyl)benzene?
You can request a quote for Pentafluoro-(iodomethyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pentafluoro-(iodomethyl)benzene?
Yes, CoreyChem provides custom synthesis services for Pentafluoro-(iodomethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.