1-Iodo-2,3,4-trimethoxybenzene
TL;DR: 1-Iodo-2,3,4-trimethoxybenzene (CAS 29944-53-4) is a chemical compound with molecular formula C9H11IO3 and molecular weight 293.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-iodo-2,3,4-trimethoxybenzene
Also Known As: 1-iodo-2,3,4-trimethoxybenzene, Iodotrimethoxybenzene, Trimethoxyiodobenzene, 2,3,4-Trimethoxyphenyl Iodide, 2,3,4-TrimethoxyphenylIodide
| Molecular Formula | C9H11IO3 |
|---|---|
| Molecular Weight | 293.98 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.97528 |
| Heavy Atoms | 13 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 29944-53-4 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)I)OC)OC |
| InChIKey | DJVXXRZXCIPZDH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Iodo-2,3,4-trimethoxybenzene (CAS 29944-53-4), with molecular formula C9H11IO3 and molecular weight 293.98 g/mol. IUPAC: 1-iodo-2,3,4-trimethoxybenzene.
Chemical Property Profile of 1-Iodo-2,3,4-trimethoxybenzene
Property Insights of 1-Iodo-2,3,4-trimethoxybenzene
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Iodo-2,3,4-trimethoxybenzene. With a topological polar surface area (TPSA) of 27.7 Ų, 1-Iodo-2,3,4-trimethoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Iodo-2,3,4-trimethoxybenzene has 0 hydrogen bond donor(s) and 3 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 1-Iodo-2,3,4-trimethoxybenzene?
The CAS number of 1-Iodo-2,3,4-trimethoxybenzene is 29944-53-4.
What is the molecular formula of 1-Iodo-2,3,4-trimethoxybenzene?
The molecular formula of 1-Iodo-2,3,4-trimethoxybenzene is C9H11IO3.
What is the molecular weight of 1-Iodo-2,3,4-trimethoxybenzene?
The molecular weight of 1-Iodo-2,3,4-trimethoxybenzene is 293.98 g/mol.
Where can I buy 1-Iodo-2,3,4-trimethoxybenzene?
You can request a quote for 1-Iodo-2,3,4-trimethoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Iodo-2,3,4-trimethoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Iodo-2,3,4-trimethoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.