Iodomesitylene
TL;DR: Iodomesitylene (CAS 4028-63-1) is a chemical compound with molecular formula C9H11I and molecular weight 245.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-iodo-1,3,5-trimethylbenzene
Also Known As: 2,4,6-Trimethyliodobenzene, 2-Iodomesitylene, Mesityl Iodide, iodomesitylene, 2-Iodo-1,3,5-trimethylbenzene
| Molecular Formula | C9H11I |
|---|---|
| Molecular Weight | 245.99 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 245.99055 |
| Heavy Atoms | 10 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 4028-63-1 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)I)C |
| InChIKey | GTPNXFKONRIHRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Iodomesitylene (CAS 4028-63-1), with molecular formula C9H11I and molecular weight 245.99 g/mol. IUPAC: 2-iodo-1,3,5-trimethylbenzene.
Chemical Property Profile of Iodomesitylene
Property Insights of Iodomesitylene
The XLogP value of 4.3 indicates that Iodomesitylene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Iodomesitylene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Iodomesitylene 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 Iodomesitylene?
The CAS number of Iodomesitylene is 4028-63-1.
What is the molecular formula of Iodomesitylene?
The molecular formula of Iodomesitylene is C9H11I.
What is the molecular weight of Iodomesitylene?
The molecular weight of Iodomesitylene is 245.99 g/mol.
Where can I buy Iodomesitylene?
You can request a quote for Iodomesitylene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iodomesitylene?
Yes, KEHONG BIO provides custom synthesis services for Iodomesitylene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.