2,3-Dimethyliodobenzene
TL;DR: 2,3-Dimethyliodobenzene (CAS 31599-60-7) is a chemical compound with molecular formula C8H9I and molecular weight 231.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-iodo-2,3-dimethylbenzene
Also Known As: 1-Iodo-2,3-dimethylbenzene, 3-Iodo-o-xylene, 2,3-Dimethyliodobenzene, 1,2-dimethyl-3-iodobenzene, null
| Molecular Formula | C8H9I |
|---|---|
| Molecular Weight | 231.97 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 231.9749 |
| Heavy Atoms | 9 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 31599-60-7 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)I)C |
| InChIKey | DANMWBNOPFBJSZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Dimethyliodobenzene (CAS 31599-60-7), with molecular formula C8H9I and molecular weight 231.97 g/mol. IUPAC: 1-iodo-2,3-dimethylbenzene.
Chemical Property Profile of 2,3-Dimethyliodobenzene
Property Insights of 2,3-Dimethyliodobenzene
The XLogP value of 3.3 indicates that 2,3-Dimethyliodobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3-Dimethyliodobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethyliodobenzene 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 2,3-Dimethyliodobenzene?
The CAS number of 2,3-Dimethyliodobenzene is 31599-60-7.
What is the molecular formula of 2,3-Dimethyliodobenzene?
The molecular formula of 2,3-Dimethyliodobenzene is C8H9I.
What is the molecular weight of 2,3-Dimethyliodobenzene?
The molecular weight of 2,3-Dimethyliodobenzene is 231.97 g/mol.
Where can I buy 2,3-Dimethyliodobenzene?
You can request a quote for 2,3-Dimethyliodobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethyliodobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethyliodobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.