2-Iodotoluene
TL;DR: 2-Iodotoluene (CAS 615-37-2) is a chemical compound with molecular formula C7H7I and molecular weight 217.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-iodo-2-methylbenzene
Also Known As: 2-Iodotoluene, 1-Iodo-2-methylbenzene, O-IODOTOLUENE, o-Tolyl iodide, Toluene, o-iodo-
| Molecular Formula | C7H7I |
|---|---|
| Molecular Weight | 217.96 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 217.95924 |
| Heavy Atoms | 8 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 615-37-2 |
|---|---|
| SMILES | CC1=CC=CC=C1I |
| InChIKey | RINOYHWVBUKAQE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Iodotoluene (CAS 615-37-2), with molecular formula C7H7I and molecular weight 217.96 g/mol. IUPAC: 1-iodo-2-methylbenzene.
Chemical Property Profile of 2-Iodotoluene
Property Insights of 2-Iodotoluene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Iodotoluene. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Iodotoluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Iodotoluene 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 2-Iodotoluene?
The CAS number of 2-Iodotoluene is 615-37-2.
What is the molecular formula of 2-Iodotoluene?
The molecular formula of 2-Iodotoluene is C7H7I.
What is the molecular weight of 2-Iodotoluene?
The molecular weight of 2-Iodotoluene is 217.96 g/mol.
Where can I buy 2-Iodotoluene?
You can request a quote for 2-Iodotoluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Iodotoluene?
Yes, KEHONG BIO provides custom synthesis services for 2-Iodotoluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.