2-Fluoro-5-iodobenzonitrile
TL;DR: 2-Fluoro-5-iodobenzonitrile (CAS 351003-36-6) is a chemical compound with molecular formula C7H3FIN and molecular weight 246.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-5-iodobenzonitrile
Also Known As: 2-Fluoro-5-iodobenzonitrile, 2-fluoro-5-iodobenzonitirile, 2-fluoro-5-iodo-benzonitrile, TPyPA, Benzonitrile, 2-fluoro-5-iodo-
| Molecular Formula | C7H3FIN |
|---|---|
| Molecular Weight | 246.93 g/mol |
| LogP | 2.30198 |
| Topological Polar Surface Area | 23.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 246.92941 |
| Heavy Atoms | 10 |
| Complexity | 290.14786 |
Chemical Identifiers
| CAS Number | 351003-36-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1I)C#N)F |
Product Overview
2-Fluoro-5-iodobenzonitrile (CAS 351003-36-6), with molecular formula C7H3FIN and molecular weight 246.93 g/mol. IUPAC: 2-fluoro-5-iodobenzonitrile.
Chemical Property Profile of 2-Fluoro-5-iodobenzonitrile
Property Insights of 2-Fluoro-5-iodobenzonitrile
The XLogP value of 2.30198 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluoro-5-iodobenzonitrile. With a topological polar surface area (TPSA) of 23.79 Ų, 2-Fluoro-5-iodobenzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-5-iodobenzonitrile has 0 hydrogen bond donor(s) and 1 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 2-Fluoro-5-iodobenzonitrile?
The CAS number of 2-Fluoro-5-iodobenzonitrile is 351003-36-6.
What is the molecular formula of 2-Fluoro-5-iodobenzonitrile?
The molecular formula of 2-Fluoro-5-iodobenzonitrile is C7H3FIN.
What is the molecular weight of 2-Fluoro-5-iodobenzonitrile?
The molecular weight of 2-Fluoro-5-iodobenzonitrile is 246.93 g/mol.
Where can I buy 2-Fluoro-5-iodobenzonitrile?
You can request a quote for 2-Fluoro-5-iodobenzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-5-iodobenzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-5-iodobenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.