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Ioxilan structure
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Ioxilan

TL;DR: Ioxilan (CAS 107793-72-6) is a chemical compound with molecular formula C18H24I3N3O8 and molecular weight 790.8698 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-[acetyl(2,3-dihydroxypropyl)amino]-3-N-(2,3-dihydroxypropyl)-1-N-(2-hydroxyethyl)-2,4,6-triiodobenzene-1,3-dicarboxamide

Also Known As: ioxilan, Oxilan, Ioxitol, Ioxilane, Ioxilanum

CAS Number
107793-72-6
Molecular Formula
C18H24I3N3O8
Molecular Weight
790.8698 g/mol
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Application Areas

Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (3 patents) Analytical Reagents (15 patents) Biotechnology (14 patents) Catalysts (3 patents) Heterocyclic Building Blocks (4 patents)

Technical Specifications

Molecular FormulaC18H24I3N3O8
Molecular Weight790.8698 g/mol
XLogP-2.4
Topological Polar Surface Area (TPSA)180.0 Ų
Hydrogen Bond Donors7
Hydrogen Bond Acceptors8
Rotatable Bonds11
Exact Mass790.8698 Da
Heavy Atoms32
Complexity647.0
SMILESCC(=O)N(CC(CO)O)C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)C(=O)NCCO)I
InChIKeyUUMLTINZBQPNGF-UHFFFAOYSA-N

Chemical Property Profile of Ioxilan

XLogP
-2.4
TPSA (Topological Polar Surface Area)
180.0
Hydrogen Bond Donors
7
Hydrogen Bond Acceptors
8
Rotatable Bonds
11
Heavy Atoms
32
Complexity
647.0
Exact Mass
790.8698
Monoisotopic Mass
790.8698
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Ioxilan

The XLogP value of -2.4 indicates that Ioxilan is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 180.0 Ų indicates high polarity, suggesting Ioxilan may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ioxilan has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Ioxilan?

The CAS number of Ioxilan is 107793-72-6.

What is the molecular formula of Ioxilan?

The molecular formula of Ioxilan is C18H24I3N3O8.

What is the molecular weight of Ioxilan?

The molecular weight of Ioxilan is 790.8698 g/mol.

Where can I buy Ioxilan?

You can request a quote for Ioxilan directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Ioxilan?

Yes, CoreyChem provides custom synthesis services for Ioxilan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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