4-Iodopentylbenzene
TL;DR: 4-Iodopentylbenzene (CAS 85017-60-3) is a chemical compound with molecular formula C11H15I and molecular weight 274.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-iodo-4-pentylbenzene
Also Known As: 4-Iodopentylbenzene, 1-Iodo-4-pentylbenzene, 1-iodo-4-n-pentylbenzene, 4-pentyliodobenzene, 1-Iodo-4-pentylbenzene #
| Molecular Formula | C11H15I |
|---|---|
| Molecular Weight | 274.02 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.02185 |
| Heavy Atoms | 12 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 85017-60-3 |
|---|---|
| SMILES | CCCCCC1=CC=C(C=C1)I |
| InChIKey | MTRMOYSZRPLAOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Iodopentylbenzene (CAS 85017-60-3), with molecular formula C11H15I and molecular weight 274.02 g/mol. IUPAC: 1-iodo-4-pentylbenzene.
Chemical Property Profile of 4-Iodopentylbenzene
Property Insights of 4-Iodopentylbenzene
The XLogP value of 5.0 indicates that 4-Iodopentylbenzene 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-Iodopentylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Iodopentylbenzene has 0 hydrogen bond donor(s) and 0 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-Iodopentylbenzene?
The CAS number of 4-Iodopentylbenzene is 85017-60-3.
What is the molecular formula of 4-Iodopentylbenzene?
The molecular formula of 4-Iodopentylbenzene is C11H15I.
What is the molecular weight of 4-Iodopentylbenzene?
The molecular weight of 4-Iodopentylbenzene is 274.02 g/mol.
Where can I buy 4-Iodopentylbenzene?
You can request a quote for 4-Iodopentylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Iodopentylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 4-Iodopentylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.