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2-Hexyldecanoic acid

Alias: Pentadecane-7-carboxylic Acid; Isopalmitic Acid; 2-Hexyldecanoic acid
Cat No.:V17575 Purity: ≥98%
2-hexyldecanoic acid works as an amidating agent.
2-Hexyldecanoic acid
2-Hexyldecanoic acid Chemical Structure CAS No.: 25354-97-6
Product category: New1
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
5g
Other Sizes
Official Supplier of:
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Product Description
2-hexyldecanoic acid works as an amidating agent.
2-Hexyldecanoic acid (CAS 25354-97-6) is a branched-chain saturated fatty acid. It is a lipid containing one carboxylic acid group and two non-polar tails. Due to its unique amphiphilic properties, it is used in various research applications, including the preparation of cationic lipids and lipid nanoparticles for drug delivery.
Biological Activity I Assay Protocols (From Reference)
Targets
This compound does not have a specific biological target. Its function is as a lipid excipient or building block. It is used in the preparation of cationic lipids for the delivery of nucleic acids, such as siRNA, to suppress the expression of target genes like the hepatitis B virus gene.
ln Vitro
As an excipient, 2-Hexyldecanoic acid has no direct biological activity. Its activity is structural; it is incorporated into larger lipid structures to facilitate drug delivery. It has been shown to inhibit the growth of prostate cancer cells and possess antibacterial activity against gram-positive bacteria.
ln Vivo
This compound is not a drug with intrinsic in vivo activity. Its in vivo function is realized when it is used to formulate a therapeutic agent, such as in lipid nanoparticles for nucleic acid delivery. It can also serve as an aerolysin inhibitor to prevent bacterial pathogens.
Enzyme Assay
As a chemical compound, there is no biological assay for 2-Hexyldecanoic acid's "activity." Its utility is demonstrated in formulation studies. The ability of the lipid to form stable nanoparticles or liposomes and efficiently encapsulate and deliver nucleic acids is assessed.
Cell Assay
There are no cell-based assays for the compound itself. Its efficacy is evaluated in cell-based assays using the final lipid nanoparticle formulation. These assays measure cellular uptake of the nucleic acid cargo and the resulting gene silencing or protein expression effects.
Animal Protocol
Animal studies are performed with the final therapeutic formulation (e.g., lipid nanoparticles containing siRNA). These studies assess the biodistribution, efficacy (e.g., suppression of a target gene), and safety of the delivery system.
ADME/Pharmacokinetics
Pharmacokinetic properties are determined for the formulated drug (e.g., lipid nanoparticles), not for the fatty acid alone. 2-Hexyldecanoic acid contributes to the stability and compatibility of the formulation, which can enhance the delivery and absorption of active compounds through the skin in topical applications.
Toxicity/Toxicokinetics
2-Hexyldecanoic acid is generally considered safe for its intended use as an excipient. However, it can cause contact dermatitis in some individuals. Safety data is typically associated with the final formulation rather than the individual component.
Additional Infomation
Hexyldecanoic acid is a medium-chain fatty acid.
2-Hexyldecanoic acid is a versatile research chemical used in lipid-based drug delivery systems for nucleic acids, such as siRNA for gene silencing. It is also used as an excipient in topical pharmaceutical formulations to enhance skin penetration. It is an important building block for creating complex lipid structures.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C16H32O2
Molecular Weight
256.43
Exact Mass
256.24
CAS #
25354-97-6
PubChem CID
32912
Appearance
Colorless to light yellow liquid(Density:0.88 g/cm3)
Density
0,88 g/cm3
Boiling Point
165-168°C 2mm
Melting Point
10°C
Flash Point
174°C
Vapour Pressure
1.6E-06mmHg at 25°C
Index of Refraction
1.4460
LogP
5.408
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
13
Heavy Atom Count
18
Complexity
190
Defined Atom Stereocenter Count
0
SMILES
C(C(CCCCCCCC)C(O)=O)CCCCC
InChi Key
JMOLZNNXZPAGBH-UHFFFAOYSA-N
InChi Code
InChI=1S/C16H32O2/c1-3-5-7-9-10-12-14-15(16(17)18)13-11-8-6-4-2/h15H,3-14H2,1-2H3,(H,17,18)
Chemical Name
2-hexyldecanoic acid
Synonyms
Pentadecane-7-carboxylic Acid; Isopalmitic Acid; 2-Hexyldecanoic 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 : ~100 mg/mL (~389.99 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (9.75 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% Saline (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 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 (9.75 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 3.8997 mL 19.4985 mL 38.9970 mL
5 mM 0.7799 mL 3.8997 mL 7.7994 mL
10 mM 0.3900 mL 1.9498 mL 3.8997 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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