3,4-Diiodotoluene
TL;DR: 3,4-Diiodotoluene (CAS 1608-47-5) is a chemical compound with molecular formula C7H6I2 and molecular weight 343.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-diiodo-4-methylbenzene
Also Known As: 3,4-Diiodotoluene, 1,2-diiodo-4-methylbenzene, 3,4-diiodo-toluene, Benzene, 1,2-diiodo-4-methyl-, 1,2-diiodo-4-methyl-benzene
| Molecular Formula | C7H6I2 |
|---|---|
| Molecular Weight | 343.86 g/mol |
| LogP | 3.20422 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 343.8559 |
| Heavy Atoms | 9 |
| Complexity | 218.15617 |
Chemical Identifiers
| CAS Number | 1608-47-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)I)I |
Product Overview
3,4-Diiodotoluene (CAS 1608-47-5), with molecular formula C7H6I2 and molecular weight 343.86 g/mol. IUPAC: 1,2-diiodo-4-methylbenzene.
Chemical Property Profile of 3,4-Diiodotoluene
Property Insights of 3,4-Diiodotoluene
The XLogP value of 3.20422 indicates that 3,4-Diiodotoluene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,4-Diiodotoluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Diiodotoluene 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 3,4-Diiodotoluene?
The CAS number of 3,4-Diiodotoluene is 1608-47-5.
What is the molecular formula of 3,4-Diiodotoluene?
The molecular formula of 3,4-Diiodotoluene is C7H6I2.
What is the molecular weight of 3,4-Diiodotoluene?
The molecular weight of 3,4-Diiodotoluene is 343.86 g/mol.
Where can I buy 3,4-Diiodotoluene?
You can request a quote for 3,4-Diiodotoluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Diiodotoluene?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Diiodotoluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.