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Tetradecanedioic acid

Cat No.:V39910 Purity: ≥98%
Tetradecanedioic acid is an endogenously produced metabolite and is a long-chain fatty acid organic/chemical reagent.
Tetradecanedioic acid
Tetradecanedioic acid Chemical Structure CAS No.: 821-38-5
Product category: New2
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
50g
Other Sizes

Other Forms of Tetradecanedioic acid:

  • Tetradecanedioic acid-d24
Official Supplier of:
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Top Publications Citing lnvivochem Products
Product Description
Tetradecanedioic acid is an endogenously produced metabolite and is a long-chain fatty acid organic/chemical reagent. Tetradecanedioic acid may serve as a candidate biomarker for active molecule-active molecule interactions mediated by organic anion transporting peptides.
Tetradecanedioic acid (CAS 821-38-5) is an α,ω-dicarboxylic acid and an endogenously produced metabolite. The compound has molecular formula C₁₄H₂₆O₄ and molecular weight 258.35 g/mol. It appears as a white to almost white powder to crystal with a melting point of 125-128°C. Tetradecanedioic acid is a long-chain fatty acid organic/chemical reagent produced by the oxidation of the methyl group in tetradecane to the corresponding carboxylic acid. It is a human metabolic byproduct. The compound is primarily used in the synthesis of synthetic fragrances, high-grade engineering plastics such as nylon 1414, hot-melt adhesives, and coatings. It is an important industrial product among long-chain dicarboxylic acids.
Biological Activity I Assay Protocols (From Reference)
ln Vitro
In vitro, Tetradecanedioic acid is primarily used as a chemical reagent and industrial intermediate rather than as a pharmacological agent. It is an α,ω-dicarboxylic acid and a human metabolic byproduct. The compound's in vitro activity is related to its chemical properties as a long-chain dicarboxylic acid rather than specific biological effects. It may be used in biochemical studies of fatty acid metabolism as a substrate or reference compound. Tetradecanedioic acid is also used in the synthesis of synthetic fragrances and high-grade engineering plastics. Its role as an endogenously produced metabolite suggests it may participate in normal metabolic processes, though its specific biological functions require further investigation.
ln Vivo
In vivo, Tetradecanedioic acid is an endogenously produced metabolite and a human metabolic byproduct. As a long-chain dicarboxylic acid, it is formed by the oxidation of fatty acids and may be involved in fatty acid metabolism pathways. The compound is primarily used industrially for the synthesis of synthetic fragrances, high-grade engineering plastics such as nylon 1414, hot-melt adhesives, and coatings. It is not used therapeutically. The compound's presence in humans reflects its role as a metabolic intermediate in fatty acid oxidation. Further research is needed to elucidate its physiological functions and potential biological activities.
Enzyme Assay
In vitro enzyme/receptor binding (non-cellular) assays are not applicable to Tetradecanedioic acid, as it is primarily a chemical reagent and industrial intermediate rather than a bioactive compound. However, the compound may be used as a substrate or reference standard in studies of fatty acid metabolism. Enzyme activity assays for fatty acid oxidation enzymes (e.g., acyl-CoA synthetase, acyl-CoA dehydrogenase) may use dicarboxylic acids as substrates. The compound's chemical properties make it useful as a building block in organic synthesis. Its role as an endogenously produced metabolite suggests it may be relevant to studies of metabolic pathways, but specific pharmacological assays are not established.
Cell Assay
In vitro cellular experiments with Tetradecanedioic acid are not typically performed for pharmacological evaluation, as the compound is primarily a chemical reagent and industrial intermediate. However, cellular studies of fatty acid metabolism may use the compound as a substrate or metabolite for investigating dicarboxylic acid transport, metabolism, or toxicity. Cell lines such as hepatocytes or adipocytes may be treated with varying concentrations of the compound, and effects on lipid metabolism, energy production, or cell viability may be assessed. The compound's role as a human metabolic byproduct makes it relevant to studies of metabolic disorders.
Animal Protocol
In vivo animal studies with Tetradecanedioic acid are not typically performed for therapeutic development, as the compound is primarily an industrial intermediate and chemical reagent. However, metabolic studies may investigate the compound's role as an endogenously produced metabolite. Animals may be administered the compound to study its metabolism, tissue distribution, and excretion. As a dicarboxylic acid, it would be expected to be metabolized through β-oxidation pathways. However, detailed in vivo pharmacokinetic and toxicological data are not extensively reported. The compound is intended for industrial and research use only.
ADME/Pharmacokinetics
Pharmacokinetic properties of Tetradecanedioic acid are not extensively characterized for therapeutic applications. The compound has molecular formula C₁₄H₂₆O₄ and molecular weight 258.35 g/mol. It appears as a white to almost white powder to crystal with a melting point of 125-128°C. Purity: min. 95.0% (GC) or min. 98.0% (neutralization titration). Storage: room temperature (below 15°C in a cool, dry place). As a dicarboxylic acid with a 14-carbon chain, it is expected to have limited water solubility and moderate lipophilicity. It is primarily used as an industrial intermediate and chemical reagent. Detailed pharmacokinetic parameters require further investigation.
Toxicity/Toxicokinetics
Toxicological information for Tetradecanedioic acid is not extensively detailed in the available literature. The compound appears as a white to almost white powder to crystal. As a dicarboxylic acid, it may cause skin, eye, or respiratory irritation at high concentrations. Standard safety precautions for handling research chemicals apply, including use of personal protective equipment (gloves, safety goggles, lab coat) and working in a well-ventilated area. The compound is primarily used as an industrial intermediate and is not approved for human therapeutic use. Storage: room temperature (below 15°C in a cool, dry place).
References

[1]. LC-MS/MS bioanalysis of plasma 1, 14-tetradecanedioic acid and 1, 16-hexadecanedioic acid as candidate biomarkers for organic anion-transporting polypeptide mediated drug-drug interactions. Bioanalysis. 2018 Sep 1;10(18):1473-1485.

Additional Infomation
Tetradecanedioic acid is an α,ω-dicarboxylic acid, a product of the oxidation of the methyl group in tetradecane to the corresponding carboxylic acid. It is a human metabolic byproduct. It is both an α,ω-dicarboxylic acid and a dicarboxylic acid fatty acid. It is the conjugate acid of Tetradecanedioic acid ester (2-). It is derived from the hydride of tetradecane. Tetradecanedioic acid has been reported to exist in fruit flies, Arabidopsis thaliana, and radiata pine, and relevant data are available.
Tetradecanedioic acid (CAS 821-38-5) is an α,ω-dicarboxylic acid and an endogenously produced metabolite. The compound has molecular formula C₁₄H₂₆O₄ and molecular weight 258.35 g/mol. It appears as a white to almost white powder to crystal with a melting point of 125-128°C. Tetradecanedioic acid is a long-chain fatty acid organic/chemical reagent produced by oxidation of tetradecane. It is a human metabolic byproduct. The compound is used in the synthesis of synthetic fragrances, high-grade engineering plastics such as nylon 1414, hot-melt adhesives, and coatings. Purity: min. 98.0%. Storage: room temperature (below 15°C in a cool, dry place).
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C14H26O4
Molecular Weight
258.3538
Exact Mass
258.183
CAS #
821-38-5
Related CAS #
Tetradecanedioic acid-d24;130348-88-8
PubChem CID
13185
Appearance
White to off-white solid powder
Density
1.0±0.1 g/cm3
Boiling Point
434.1±18.0 °C at 760 mmHg
Melting Point
124-127 °C(lit.)
Flash Point
230.5±17.7 °C
Vapour Pressure
0.0±2.2 mmHg at 25°C
Index of Refraction
1.475
LogP
3.99
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
13
Heavy Atom Count
18
Complexity
202
Defined Atom Stereocenter Count
0
InChi Key
HQHCYKULIHKCEB-UHFFFAOYSA-N
InChi Code
InChI=1S/C14H26O4/c15-13(16)11-9-7-5-3-1-2-4-6-8-10-12-14(17)18/h1-12H2,(H,15,16)(H,17,18)
Chemical Name
tetradecanedioic acid
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)
DMSO : ~50 mg/mL (~193.53 mM)
Solubility (In Vivo)
Solubility in Formulation 1: 2.5 mg/mL (9.68 mM) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), suspension solution; with sonication.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL.
Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution.

Solubility in Formulation 2: ≥ 2.5 mg/mL (9.68 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution.
For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 3.8707 mL 19.3536 mL 38.7072 mL
5 mM 0.7741 mL 3.8707 mL 7.7414 mL
10 mM 0.3871 mL 1.9354 mL 3.8707 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
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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.

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  • 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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