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Iopentol

Cat No.:V46562 Purity: ≥98%
Iopentol is a non-ionic intravascular contrast agent.
Iopentol
Iopentol Chemical Structure CAS No.: 89797-00-2
Product category: New3
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
1mg
5mg
Other Sizes
Official Supplier of:
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Product Description
Iopentol is a non-ionic intravascular contrast agent.
Iopentol (Imagopaque) is a nonionic, water-soluble, monomeric, tri-iodinated contrast agent for X-ray imaging. It is used in diagnostic radiology for angiography, urography, and computed tomography (CT) scans. It is formulated as a sterile solution for intravenous or intra-arterial injection.
Biological Activity I Assay Protocols (From Reference)
Targets
Iopentol does not bind to a specific protein target. Its function is physical: the iodine atoms in the molecule absorb X-rays due to their high atomic number, creating radiographic contrast. When injected into blood vessels or body cavities, it opacifies these structures, making them visible under X-ray.
ln Vitro
In vitro, iopentol is used as an imaging agent in phantoms to calibrate X-ray and CT equipment. It has no cytotoxic or pharmacodynamic activity. It is chemically stable and non-reactive with blood components. Its iodine content (300-350 mg/mL in formulations) determines the degree of X-ray attenuation.
ln Vivo
Dedicated in vivo animal studies have demonstrated the safety and efficacy of iopentol for vascular opacification. It is rapidly distributed in the intravascular space after injection and is excreted unchanged by the kidneys via glomerular filtration. It does not undergo significant metabolism.
Enzyme Assay
In vitro assays are not performed for this contrast agent. Its physicochemical properties, such as osmolality, viscosity, and iodine content, are characterized. The opacification effect is measured using X-ray attenuation or CT number (Hounsfield units) in comparison to water and reference standards.
Cell Assay
Cell-based assays are not performed for iopentol. As an inert contrast agent, it is not intended to interact with cellular targets. Cytotoxicity studies are not required for regulatory approval beyond standard biocompatibility testing (e.g., hemolysis, pyrogenicity) according to ISO 10993 standards for medical devices.
Animal Protocol
In animal studies (typically dogs, rabbits, or pigs), iopentol is administered intravenously or intra-arterially at clinically relevant doses (e.g., 1-2 mL/kg of 300-350 mg I/mL). Contrast enhancement in blood vessels (e.g., aorta, renal arteries) is measured by CT or digital subtraction angiography. Safety is assessed by monitoring vital signs and renal function.
ADME/Pharmacokinetics
Iopentol is an extracellular contrast agent. After intravenous injection, it rapidly distributes in the intravascular space. It has a distribution half-life of approximately 20-30 minutes and an elimination half-life of 1-2 hours in patients with normal renal function. It is excreted unchanged by glomerular filtration with no significant metabolism.
Toxicity/Toxicokinetics
Iopentol has a favorable safety profile. Common adverse reactions include nausea, headache, and injection site pain. Serious adverse events such as anaphylactoid reactions, nephrotoxicity, or contrast-induced acute kidney injury are rare. Iopentol is considered to have lower osmolality and lower risk of adverse reactions compared to older ionic contrast agents.
Additional Infomation
Iopental sodium is an aminobenzoic acid. Iopental sodium is used as a contrast agent.
Iopentol is a commercially available X-ray contrast agent marketed under the brand name Imagopaque (GE Healthcare). It is approved for use in multiple countries for angiography, urography, and CT imaging. It belongs to the class of low-osmolar nonionic monomers (LOCM). It is a diagnostic drug, not a therapeutic.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C20H28N3O9I3
Molecular Weight
835.163020000001
Exact Mass
834.896
CAS #
89797-00-2
PubChem CID
56016
Appearance
White to off-white solid powder
Density
2.095g/cm3
Boiling Point
858.8ºC at 760 mmHg
Flash Point
473.2ºC
Index of Refraction
1.693
LogP
0.176
Hydrogen Bond Donor Count
7
Hydrogen Bond Acceptor Count
9
Rotatable Bond Count
13
Heavy Atom Count
35
Complexity
668
Defined Atom Stereocenter Count
0
SMILES
O=C(C1C(I)=C(N(CC(COC)O)C(C)=O)C(I)=C(C(NCC(CO)O)=O)C=1I)NCC(CO)O
InChi Key
IUNJANQVIJDFTQ-UHFFFAOYSA-N
InChi Code
InChI=1S/C20H28I3N3O9/c1-9(29)26(5-12(32)8-35-2)18-16(22)13(19(33)24-3-10(30)6-27)15(21)14(17(18)23)20(34)25-4-11(31)7-28/h10-12,27-28,30-32H,3-8H2,1-2H3,(H,24,33)(H,25,34)
Chemical Name
5-[acetyl-(2-hydroxy-3-methoxypropyl)amino]-1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
HS Tariff Code
2934.99.9001
Storage

Powder      -20°C    3 years

                     4°C     2 years

In solvent   -80°C    6 months

                  -20°C    1 month

Shipping Condition
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
Solubility Data
Solubility (In Vitro)
May dissolve in DMSO (in most cases), if not, try other solvents such as H2O, Ethanol, or DMF with a minute amount of products to avoid loss of samples
Solubility (In Vivo)
Note: Listed below are some common formulations that may be used to formulate products with low water solubility (e.g. < 1 mg/mL), you may test these formulations using a minute amount of products to avoid loss of samples.

Injection Formulations
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH ₂ O to obtain a clear solution.
Injection Formulation 2: DMSO : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL DMSO 400 μLPEG300 50 μL Tween 80 450 μL Saline)
Injection Formulation 3: DMSO : Corn oil = 10 : 90 (i.e. 100 μL DMSO 900 μL Corn oil)
Example: Take the Injection Formulation 3 (DMSO : Corn oil = 10 : 90) as an example, if 1 mL of 2.5 mg/mL working solution is to be prepared, you can take 100 μL 25 mg/mL DMSO stock solution and add to 900 μL corn oil, mix well to obtain a clear or suspension solution (2.5 mg/mL, ready for use in animals).
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Injection Formulation 4: DMSO : 20% SBE-β-CD in saline = 10 : 90 [i.e. 100 μL DMSO 900 μL (20% SBE-β-CD in saline)]
*Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL Saline)


Oral Formulations
Oral Formulation 1: Suspend in 0.5% CMC Na (carboxymethylcellulose sodium)
Oral Formulation 2: Suspend in 0.5% Carboxymethyl cellulose
Example: Take the Oral Formulation 1 (Suspend in 0.5% CMC Na) as an example, if 100 mL of 2.5 mg/mL working solution is to be prepared, you can first prepare 0.5% CMC Na solution by measuring 0.5 g CMC Na and dissolve it in 100 mL ddH2O to obtain a clear solution; then add 250 mg of the product to 100 mL 0.5% CMC Na solution, to make the suspension solution (2.5 mg/mL, ready for use in animals).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 1.1974 mL 5.9869 mL 11.9738 mL
5 mM 0.2395 mL 1.1974 mL 2.3948 mL
10 mM 0.1197 mL 0.5987 mL 1.1974 mL

*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.

Calculator

Molarity Calculator allows you to calculate the mass, volume, and/or concentration required for a solution, as detailed below:

  • Calculate the Mass of a compound required to prepare a solution of known volume and concentration
  • Calculate the Volume of solution required to dissolve a compound of known mass to a desired concentration
  • Calculate the Concentration of a solution resulting from a known mass of compound in a specific volume
An example of molarity calculation using the molarity calculator is shown below:
What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
  • Enter 350.26 in the Molecular Weight (MW) box
  • Enter 10 in the Concentration box and choose the correct unit (mM)
  • Enter 5 in the Volume box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

Dilution Calculator allows you to calculate how to dilute a stock solution of known concentrations. For example, you may Enter C1, C2 & V2 to calculate V1, as detailed below:

What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
  • Enter 10 into the Concentration (Start) box and choose the correct unit (mM)
  • Enter 25 into the Concentration (End) box and select the correct unit (mM)
  • Enter 25 into the Volume (End) box and choose the correct unit (mL)
  • Click the “Calculate” button
  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
g/mol

Molecular Weight Calculator allows you to calculate the molar mass and elemental composition of a compound, as detailed below:

Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
Instructions to calculate molar mass (molecular weight) of a chemical compound:
  • To calculate molar mass of a chemical compound, please enter the chemical/molecular formula and click the “Calculate’ button.
Definitions of molecular mass, molecular weight, molar mass and molar weight:
  • Molecular mass (or molecular weight) is the mass of one molecule of a substance and is expressed in the unified atomic mass units (u). (1 u is equal to 1/12 the mass of one atom of carbon-12)
  • Molar mass (molar weight) is the mass of one mole of a substance and is expressed in g/mol.
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Reconstitution Calculator allows you to calculate the volume of solvent required to reconstitute your vial.

  • Enter the mass of the reagent and the desired reconstitution concentration as well as the correct units
  • Click the “Calculate” button
  • The answer appears in the Volume (to add to vial) box
In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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Calculation results

Working concentration mg/mL;

Method for preparing DMSO stock solution mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.

Method for preparing in vivo formulation:Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O,mix and clarify.

(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
             (2) Be sure to add the solvent(s) in order.

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