4-氟苄基碘
TL;DR: 4-氟苄基碘 (CAS 3831-29-6) is a chemical compound with molecular formula C7H6FI and molecular weight 235.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氟苄基碘
1-fluoro-4-(iodomethyl)benzene
Also Known As: 4-Fluorobenzyl iodide, 1-fluoro-4-(iodomethyl)benzene, p-fluorobenzyl iodide, Benzene, 1-fluoro-4-(iodomethyl)-, p-FC6H4CH2I
| Molecular Formula | C7H6FI |
|---|---|
| Molecular Weight | 235.95 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 235.94983 |
| Heavy Atoms | 9 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 3831-29-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CI)F |
| InChIKey | UULYZGVRBYESOA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氟苄基碘 (CAS 3831-29-6), with molecular formula C7H6FI and molecular weight 235.95 g/mol. IUPAC: 1-fluoro-4-(iodomethyl)benzene.
Chemical Property Profile of 4-氟苄基碘
Property Insights of 4-氟苄基碘
The XLogP value of 3.0 indicates that 4-氟苄基碘 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4-氟苄基碘 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氟苄基碘 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 4-氟苄基碘?
The CAS number of 4-氟苄基碘 is 3831-29-6.
What is the molecular formula of 4-氟苄基碘?
The molecular formula of 4-氟苄基碘 is C7H6FI.
What is the molecular weight of 4-氟苄基碘?
The molecular weight of 4-氟苄基碘 is 235.95 g/mol.
Where can I buy 4-氟苄基碘?
You can request a quote for 4-氟苄基碘 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氟苄基碘?
Yes, KEHONG BIO provides custom synthesis services for 4-氟苄基碘 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.