5-Iodo-1,2,3-trimethoxybenzene
TL;DR: 5-Iodo-1,2,3-trimethoxybenzene (CAS 25245-29-8) 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.
5-iodo-1,2,3-trimethoxybenzene
Also Known As: 5-Iodo-1,2,3-trimethoxybenzene, 3,4,5-trimethoxyiodobenzene, Benzene,2,3-trimethoxy-, 2-Ethoxy-6-methylpyrazine, O(C)c1c(OC)cc(I)cc1OC
| Molecular Formula | C9H11IO3 |
|---|---|
| Molecular Weight | 293.98 g/mol |
| LogP | 2.1 |
| 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 | 140.0 |
Chemical Identifiers
| CAS Number | 25245-29-8 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)I |
| InChIKey | IWPMQXOVTMABLF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Iodo-1,2,3-trimethoxybenzene (CAS 25245-29-8), with molecular formula C9H11IO3 and molecular weight 293.98 g/mol. IUPAC: 5-iodo-1,2,3-trimethoxybenzene.
Chemical Property Profile of 5-Iodo-1,2,3-trimethoxybenzene
Property Insights of 5-Iodo-1,2,3-trimethoxybenzene
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Iodo-1,2,3-trimethoxybenzene. With a topological polar surface area (TPSA) of 27.7 Ų, 5-Iodo-1,2,3-trimethoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Iodo-1,2,3-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 5-Iodo-1,2,3-trimethoxybenzene?
The CAS number of 5-Iodo-1,2,3-trimethoxybenzene is 25245-29-8.
What is the molecular formula of 5-Iodo-1,2,3-trimethoxybenzene?
The molecular formula of 5-Iodo-1,2,3-trimethoxybenzene is C9H11IO3.
What is the molecular weight of 5-Iodo-1,2,3-trimethoxybenzene?
The molecular weight of 5-Iodo-1,2,3-trimethoxybenzene is 293.98 g/mol.
Where can I buy 5-Iodo-1,2,3-trimethoxybenzene?
You can request a quote for 5-Iodo-1,2,3-trimethoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Iodo-1,2,3-trimethoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 5-Iodo-1,2,3-trimethoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.