| Size | Price | |
|---|---|---|
| Other Sizes |
| Targets |
Methyl undecanoate does not have a specific biological target. It is a fatty acid ester and is used as a chemical standard and a research chemical. Its function is related to its chemical properties, such as its use as a plasticizer or a reference compound in analytical chemistry.
|
|---|---|
| ln Vitro |
Methyl undecanoate is not used in standard in vitro biological activity assays as it is not a bioactive compound. It is a chemical reagent and an analytical standard.
|
| ln Vivo |
Methyl undecanoate is not used as a therapeutic compound and has no reported in vivo biological activity.
|
| Enzyme Assay |
Methyl undecanoate is not used in biochemical assays as an active compound. Its characterization is performed using standard analytical chemistry methods such as GC and MS, where it serves as a reference standard.
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| Cell Assay |
Methyl undecanoate is not used in cellular assays as a bioactive compound. It is a chemical reagent and analytical standard. For research use, it is typically stored at -20°C.
|
| Animal Protocol |
In vivo studies for Methyl undecanoate are not conducted as it is not a therapeutic compound.
|
| ADME/Pharmacokinetics |
Pharmacokinetic data for Methyl undecanoate are not applicable as it is not a therapeutic compound. The compound has a molecular weight of 200.32 g/mol and is typically stored at -20°C.
|
| Toxicity/Toxicokinetics |
Methyl undecanoate is a fatty acid ester and is generally considered safe as a food and fragrance component. However, as a chemical reagent, standard laboratory safety practices should be followed.
|
| References | |
| Additional Infomation |
Methyl undecanoate is a fatty acid methyl ester of undecanoic acid, a metabolite whose function is related to that of undecanoic acid. It has been reported to be found in hops, daphne, and other organisms with relevant data.
Methyl undecanoate is a fatty acid methyl ester used as a plasticizer, fragrance agent, and analytical standard. Its molecular formula is C12H24O2. It has no clinical applications and is for research use only. |
| Molecular Formula |
C12H24O2
|
|---|---|
| Molecular Weight |
200.32
|
| Exact Mass |
200.177
|
| CAS # |
1731-86-8
|
| Related CAS # |
Methyl undecanoate-d21; 1219804-96-2
|
| PubChem CID |
15607
|
| Appearance |
Colorless to light yellow liquid
|
| Density |
0.9±0.1 g/cm3
|
| Boiling Point |
246.2±3.0 °C at 760 mmHg
|
| Melting Point |
-10°C
|
| Flash Point |
109.4±0.0 °C
|
| Vapour Pressure |
0.0±0.5 mmHg at 25°C
|
| Index of Refraction |
1.430
|
| LogP |
4.96
|
| Hydrogen Bond Donor Count |
0
|
| Hydrogen Bond Acceptor Count |
2
|
| Rotatable Bond Count |
10
|
| Heavy Atom Count |
14
|
| Complexity |
132
|
| Defined Atom Stereocenter Count |
0
|
| SMILES |
CCCCCCCCCCC(=O)OC
|
| InChi Key |
XPQPWPZFBULGKT-UHFFFAOYSA-N
|
| InChi Code |
InChI=1S/C12H24O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-11H2,1-2H3
|
| Chemical Name |
methyl undecanoate
|
| 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 (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
Injection Formulation 1: DMSO : Tween 80： Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution → 50 μL Tween 80 → 850 μL Saline)(e.g. IP/IV/IM/SC) *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 : PEG300 ：Tween 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). View More
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)] 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). View More
Oral Formulation 3: Dissolved in PEG400 (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 4.9920 mL | 24.9601 mL | 49.9201 mL | |
| 5 mM | 0.9984 mL | 4.9920 mL | 9.9840 mL | |
| 10 mM | 0.4992 mL | 2.4960 mL | 4.9920 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.
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.
Products are for research use only; We do not sell to patients
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