2,4,6-Triiodo-m-cresol
TL;DR: 2,4,6-Triiodo-m-cresol (CAS 2109-12-8) is a chemical compound with molecular formula C7H5I3O and molecular weight 485.75 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-triiodo-3-methylphenol
Also Known As: 2,4,6-Triiodo-m-cresol, 2,4,6-triiodo-3-methylphenol, m-Cresol, 2,4,6-triiodo-, Phenol,2,4,6-triiodo-3-methyl-, Phenol, 2,4,6-triiodo-3-methyl-
| Molecular Formula | C7H5I3O |
|---|---|
| Molecular Weight | 485.75 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 485.7475 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 2109-12-8 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1I)I)O)I |
| InChIKey | IJHNNLYYEMRGLR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Triiodo-m-cresol (CAS 2109-12-8), with molecular formula C7H5I3O and molecular weight 485.75 g/mol. IUPAC: 2,4,6-triiodo-3-methylphenol.
Chemical Property Profile of 2,4,6-Triiodo-m-cresol
Property Insights of 2,4,6-Triiodo-m-cresol
The XLogP value of 3.9 indicates that 2,4,6-Triiodo-m-cresol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2,4,6-Triiodo-m-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,6-Triiodo-m-cresol has 1 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 2,4,6-Triiodo-m-cresol?
The CAS number of 2,4,6-Triiodo-m-cresol is 2109-12-8.
What is the molecular formula of 2,4,6-Triiodo-m-cresol?
The molecular formula of 2,4,6-Triiodo-m-cresol is C7H5I3O.
What is the molecular weight of 2,4,6-Triiodo-m-cresol?
The molecular weight of 2,4,6-Triiodo-m-cresol is 485.75 g/mol.
Where can I buy 2,4,6-Triiodo-m-cresol?
You can request a quote for 2,4,6-Triiodo-m-cresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Triiodo-m-cresol?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Triiodo-m-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.