| Size | Price | |
|---|---|---|
| Other Sizes |
| Targets |
4-Allyltoluene does not have a defined biological target in mammalian systems. Its primary known biological activity is as an insecticide, eliciting olfactory responses in insects. It is an aromatic compound that induces tactile-olfactory responses in Mediterranean fruit flies.
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|---|---|
| ln Vitro |
In vitro, 4-allyltoluene is used as an insecticide and in studies of insect olfaction. It elicits antennal olfactory responses in Mediterranean fruit flies measured by electroantennography (EAG). It is not tested for biological activity in mammalian cell-based assays.
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| ln Vivo |
4-Allyltoluene is not a pharmacologically active drug in mammals. It is used as an insecticide in research. It is not administered to animals in pharmacological studies and has no known physiological effects in mammals.
|
| Enzyme Assay |
In vitro assays for 4-allyltoluene focus on its insecticidal activity. A standard protocol involves electroantennography (EAG) to measure the olfactory response of Mediterranean fruit flies to varying concentrations of the compound. The compound is also tested for its insecticidal activity against target insect species.
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| Cell Assay |
Cell-based experiments are not performed with 4-allyltoluene, as it is an insecticide and not a test compound for mammalian biological activity.
|
| Animal Protocol |
In vivo animal studies are not conducted with 4-allyltoluene in mammals. It is used in insect studies to assess its olfactory and insecticidal effects.
|
| ADME/Pharmacokinetics |
Pharmacokinetic properties of 4-allyltoluene are not characterized, as it is not a drug substance. The compound is not intended for human exposure.
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| Toxicity/Toxicokinetics |
4-Allyltoluene may cause skin and eye irritation. Standard laboratory safety precautions should be followed when handling this compound, including the use of gloves, safety glasses, and working in a fume hood.
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| References | |
| Additional Infomation |
Used as a stabilizer for volatile haloalkanes; structure derived from a primary source.
4-Allyltoluene is an aromatic compound used as an insecticide in research. It elicits olfactory responses in Mediterranean fruit flies. It has not undergone clinical trials and is not approved as a pharmaceutical. |
| Molecular Formula |
C10H12
|
|---|---|
| Molecular Weight |
132.20
|
| Exact Mass |
132.094
|
| CAS # |
3333-13-9
|
| PubChem CID |
76851
|
| Appearance |
Typically exists as solid at room temperature
|
| Density |
0.88 g/cm3
|
| Boiling Point |
182.7ºC at 760 mmHg
|
| Flash Point |
55.7ºC
|
| Index of Refraction |
1.511
|
| LogP |
2.723
|
| Hydrogen Bond Donor Count |
0
|
| Hydrogen Bond Acceptor Count |
0
|
| Rotatable Bond Count |
2
|
| Heavy Atom Count |
10
|
| Complexity |
96.6
|
| Defined Atom Stereocenter Count |
0
|
| SMILES |
C=CCC1=CC=C(C)C=C1
|
| InChi Key |
WAEOXIOXMKNFLQ-UHFFFAOYSA-N
|
| InChi Code |
InChI=1S/C10H12/c1-3-4-10-7-5-9(2)6-8-10/h3,5-8H,1,4H2,2H3
|
| Chemical Name |
1-methyl-4-prop-2-enylbenzene
|
| 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 (In Vitro) |
DMSO: 100 mg/mL (756.43 mM)
|
|---|---|
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (18.91 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 (18.91 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), suspension 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. View More
Solubility in Formulation 3: ≥ 2.5 mg/mL (18.91 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 7.5643 mL | 37.8215 mL | 75.6430 mL | |
| 5 mM | 1.5129 mL | 7.5643 mL | 15.1286 mL | |
| 10 mM | 0.7564 mL | 3.7821 mL | 7.5643 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.
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