5-Amino-2,4,6-triiodoisophthaloyl dichloride
TL;DR: 5-Amino-2,4,6-triiodoisophthaloyl dichloride (CAS 37441-29-5) is a chemical compound with molecular formula C8H2Cl2I3NO2 and molecular weight 594.66 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-2,4,6-triiodobenzene-1,3-dicarbonyl chloride
Also Known As: 5-amino-2,4,6-triiodoisophthaloyl dichloride, Iohexol EP Impurity L, ATIPA dichloride, Iohexol impurity L, Iohexol impurity L [EP]
| Molecular Formula | C8H2Cl2I3NO2 |
|---|---|
| Molecular Weight | 594.66 g/mol |
| LogP | 3.8406 |
| Topological Polar Surface Area | 60.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 594.6597 |
| Heavy Atoms | 16 |
| Complexity | 463.54218 |
Chemical Identifiers
| CAS Number | 37441-29-5 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1I)N)I)C(=O)Cl)I)C(=O)Cl |
Product Overview
5-Amino-2,4,6-triiodoisophthaloyl dichloride (CAS 37441-29-5), with molecular formula C8H2Cl2I3NO2 and molecular weight 594.66 g/mol. IUPAC: 5-amino-2,4,6-triiodobenzene-1,3-dicarbonyl chloride.
Chemical Property Profile of 5-Amino-2,4,6-triiodoisophthaloyl dichloride
Property Insights of 5-Amino-2,4,6-triiodoisophthaloyl dichloride
The XLogP value of 3.8406 indicates that 5-Amino-2,4,6-triiodoisophthaloyl dichloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-2,4,6-triiodoisophthaloyl dichloride. Following Lipinski's Rule of Five, 5-Amino-2,4,6-triiodoisophthaloyl dichloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Amino-2,4,6-triiodoisophthaloyl dichloride?
The CAS number of 5-Amino-2,4,6-triiodoisophthaloyl dichloride is 37441-29-5.
What is the molecular formula of 5-Amino-2,4,6-triiodoisophthaloyl dichloride?
The molecular formula of 5-Amino-2,4,6-triiodoisophthaloyl dichloride is C8H2Cl2I3NO2.
What is the molecular weight of 5-Amino-2,4,6-triiodoisophthaloyl dichloride?
The molecular weight of 5-Amino-2,4,6-triiodoisophthaloyl dichloride is 594.66 g/mol.
Where can I buy 5-Amino-2,4,6-triiodoisophthaloyl dichloride?
You can request a quote for 5-Amino-2,4,6-triiodoisophthaloyl dichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-2,4,6-triiodoisophthaloyl dichloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-2,4,6-triiodoisophthaloyl dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.