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10-Undecen-1-ol

Cat No.:V61716 Purity: ≥98%
10-Undecen-1-ol, converted from ricinoleic acid, can be used as a comonomer to introduce functional groups.
10-Undecen-1-ol
10-Undecen-1-ol Chemical Structure CAS No.: 112-43-6
Product category: Others 12
This product is for research use only, not for human use. We do not sell to patients.
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Product Description
10-Undecen-1-ol, converted from ricinoleic acid, can be used as a comonomer to introduce functional groups.
10-Undecen-1-ol is a versatile long-chain unsaturated primary alcohol (alkenyl alcohol) with a terminal double bond and a primary hydroxyl group. It is primarily derived from ricinoleic acid and serves as a valuable bifunctional molecule in chemical synthesis. Its applications span from being a flavoring agent and fragrance ingredient to a crucial monomer in polymer chemistry and a precursor for synthesizing specialty chemicals, including insect pheromones.
Biological Activity I Assay Protocols (From Reference)
Targets
10-Undecen-1-ol does not have a specific, well-established biological or pharmacological target. Its value lies in its chemical reactivity as a building block. In biological research, its derivatives and related compounds, such as 10-undecenoic acid, have shown promise, including antifungal activity through the disruption of fungal cell membranes. In silico studies have suggested that some related volatile phytochemicals could potentially act as aromatase inhibitors.
ln Vitro
Step growth polymerization of undec-10-en-1-ol and CO catalyzed by cobalt results in aliphatic polyesters (Mn 104 g/mol) that are only derived from renewable resources[1].
In vitro, the compound itself is not typically studied for direct biological activity. However, its derivatives have shown promise. For instance, 10-undecenoic acid, a closely related compound, is a known antifungal agent. Research suggests that 10-Undecen-1-ol has the potential to modulate specific cellular signaling pathways by influencing the activity of certain enzymes, positioning it as a molecule of interest in fundamental research areas like cancer and inflammation.
ln Vivo
In vivo, 10-Undecen-1-ol is not administered as a therapeutic agent. Its primary applications are in industrial chemistry and as a precursor for synthesizing other compounds. While some of its derivatives may have biological applications, the parent compound itself is not used for in vivo pharmacological studies. It is considered safe for its intended uses, such as a flavoring agent in food.
Enzyme Assay
Non-cell-based assays for 10-Undecen-1-ol primarily involve characterizing its chemical properties and reactivity. These methods include Nuclear Magnetic Resonance (NMR) and Mass Spectrometry (MS) for structural confirmation, and Gas Chromatography (GC) to assess purity. Its role as a monomer is evaluated in polymerization reactions, such as Acyclic Diene Metathesis (ADMET) and copolymerization with ethylene, where its incorporation rate into polymer chains is measured.
Cell Assay
10-Undecen-1-ol is not typically used in standard cell-based assays as it is not considered a primary bioactive compound. Its role in cellular research is indirect, serving as a building block to create other molecules that might be tested in such assays. While some commercial sources suggest it can modulate cellular signaling pathways, specific experimental protocols for cell-based assays using the compound itself are not established.
Animal Protocol
10-Undecen-1-ol is not used as a therapeutic agent in animal experiments. Its primary applications are in industrial chemistry and as a precursor for synthesizing other compounds. While some of its derivatives may have biological applications, the parent compound itself is not used for in vivo pharmacological studies.
ADME/Pharmacokinetics
Pharmacokinetic properties are not applicable to 10-Undecen-1-ol in a therapeutic context. As a chemical intermediate and flavoring agent, its absorption, distribution, metabolism, and excretion (ADME) are not characterized as they would be for a drug. Its physical properties, such as being insoluble in water but soluble in alcohol, are relevant for its use in industrial and flavor applications.
Toxicity/Toxicokinetics
The toxicity of 10-Undecen-1-ol has been evaluated primarily for its use as a flavoring agent and industrial chemical. It is reported to be a mild skin irritant and a strong eye irritant. However, it is considered safe for use as a flavoring agent in food. Standard laboratory safety precautions should be followed when handling the compound to avoid exposure.
References
[1]. Quinzler D, et al. Renewable resource-based poly(dodecyloate) by carbonylation polymerization. Chem Commun (Camb). 2009;(36):5400-5402.
[2]. Jonas U. A, et al. Functional Beads of Polyvinylpyrrolidone: Promising Support Materials for Solid‐Phase Synthesis.
Additional Infomation
10-Undecen-1-ol is an enol formed by replacing a terminal methyl hydrogen atom in the 1-undecene molecule with a hydroxyl group. It is an enol, primary alcohol, and medium-chain fatty alcohol. It is derived from the hydride of 1-undecene.
It has been reported that 10-undecen-1-ol is present in mango (Mangifera indica), and relevant data are available for reference.
10-Undecen-1-ol (CAS# 112-43-6) is a colorless liquid with the molecular formula C₁₁H₂₂O and a molecular weight of 170.29 g/mol. Also known as undec-10-en-1-ol or undecylenyl alcohol, it is a primary alcohol and a medium-chain fatty alcohol. It is synthesized primarily through the reduction of 10-undecenoic acid. Its main applications are as a chemical intermediate for synthesizing polymers, specialty chemicals, and insect pheromones, and as a flavor and fragrance ingredient. It is not approved as a therapeutic agent.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C11H22O
Molecular Weight
170.29
Exact Mass
170.167
CAS #
112-43-6
PubChem CID
8185
Appearance
Colorless to light yellow liquid(Density:0.85 g/cm3 )
Density
0.8±0.1 g/cm3
Boiling Point
250.0±0.0 °C at 760 mmHg
Melting Point
-2 °C
Flash Point
93.3±0.0 °C
Vapour Pressure
0.0±1.1 mmHg at 25°C
Index of Refraction
1.448
LogP
4.09
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
9
Heavy Atom Count
12
Complexity
89
Defined Atom Stereocenter Count
0
SMILES
O([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])=C([H])[H]
InChi Key
GIEMHYCMBGELGY-UHFFFAOYSA-N
InChi Code
InChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h2,12H,1,3-11H2
Chemical Name
undec-10-en-1-ol
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

Note: Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture.
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 (587.23 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (14.68 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 (14.68 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in 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 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly.
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.

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Solubility in Formulation 3: ≥ 2.5 mg/mL (14.68 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 5.8723 mL 29.3617 mL 58.7234 mL
5 mM 1.1745 mL 5.8723 mL 11.7447 mL
10 mM 0.5872 mL 2.9362 mL 5.8723 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:

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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:
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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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