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N-Ethyl-N-methylpyrrolidinium tetrafluoroborate

Cat No.:V66599 Purity: ≥98%
1-Ethyl-1-methylpyrrolidinium Tetrafluoroborate is a biochemical compound that could be utilized as a biomaterial or organic/chemical reagent for biomedical research.
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate Chemical Structure CAS No.: 117947-85-0
Product category: Biochemical Assay Reagents
This product is for research use only, not for human use. We do not sell to patients.
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Product Description
1-Ethyl-1-methylpyrrolidinium Tetrafluoroborate is a biochemical compound that could be utilized as a biomaterial or organic/chemical reagent for biomedical research.
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate is a quaternary ammonium salt with a molecular formula of C₇H₁₆BF₄N and a molecular weight of 201.02 g/mol. It is an ionic liquid that consists of an N-ethyl-N-methylpyrrolidinium cation paired with a tetrafluoroborate anion. The compound is used as an electrolyte in electrochemical applications, including batteries and supercapacitors, and as a solvent or catalyst in organic synthesis. Ionic liquids are known for their unique properties, including low volatility and high thermal stability. It is intended for research use only.
Biological Activity I Assay Protocols (From Reference)
Targets
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate does not have a defined biological target as a therapeutic agent. It is an ionic liquid used in electrochemical applications and as a research reagent. The compound is not intended to exert pharmacological effects. Its utility lies in its physical and chemical properties as an ionic liquid, including its low volatility, high thermal stability, and good ionic conductivity.
ln Vitro
Specific in vitro activity data for N-Ethyl-N-methylpyrrolidinium tetrafluoroborate as a pharmacological agent are not documented in the literature. It is used as an ionic liquid and research reagent rather than as a drug substance. The compound is not characterized for direct biological activities such as enzyme inhibition or receptor modulation. Its effects in biological systems, if any, would be related to its potential toxicity as an ionic liquid.
ln Vivo
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate is not used for in vivo pharmacological activity assessment as a drug compound. Its primary applications are as an ionic liquid in electrochemical applications and as a research reagent. The compound is not intended to be administered to animals for pharmacological studies. Its use is limited to research and industrial applications.
Enzyme Assay
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate is not typically used in enzyme/receptor binding assays. Its primary applications are as an electrolyte in electrochemical studies and as a solvent or catalyst in organic synthesis. When used in research, it may be employed in studies of ionic liquid properties or in electrochemical applications. Standard chemical protocols are employed for its use.
Cell Assay
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate is not used in cell-based assays as a test compound. Its primary applications are as an ionic liquid and research reagent. The compound is not characterized for direct cellular effects. Its potential toxicity is a concern in laboratory settings, but it is not evaluated for pharmacological effects.
Animal Protocol
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate is not used in animal studies as a pharmacological agent. Its primary applications are as an ionic liquid and research reagent. The compound is not intended to be administered to animals for efficacy evaluations. Its use is limited to research and industrial applications.
ADME/Pharmacokinetics
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate has a molecular weight of 201.02 g/mol and a molecular formula of C₇H₁₆BF₄N. It is an ionic liquid consisting of an N-ethyl-N-methylpyrrolidinium cation and a tetrafluoroborate anion. The compound is used as an electrolyte in electrochemical applications and as a research reagent. It is typically stored under standard laboratory conditions.
Toxicity/Toxicokinetics
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate is intended for research use only and is not approved for human therapeutic applications. As an ionic liquid, comprehensive toxicological data are not extensively documented in the publicly accessible literature. Standard safety precautions should be observed when handling this compound, including the use of appropriate personal protective equipment. The compound should be handled in well-ventilated areas with proper waste disposal procedures.
Additional Infomation
N-Ethyl-N-methylpyrrolidinium tetrafluoroborate (CAS#: 117947-85-0) has a molecular formula of C₇H₁₆BF₄N and a molecular weight of 201.02 g/mol. It is an ionic liquid used as an electrolyte in electrochemical applications and as a research reagent. This compound is not a drug and has not undergone clinical trials.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C7H16BF4N
Molecular Weight
201.01
Exact Mass
201.131
CAS #
117947-85-0
PubChem CID
18374068
Appearance
White to off-white solid powder
Melting Point
286 °C(dec.)
LogP
2.505
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
1
Heavy Atom Count
13
Complexity
91.6
Defined Atom Stereocenter Count
0
SMILES
F[B-](F)(F)F.[N+]1(C([H])([H])[H])(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C1([H])[H]
InChi Key
LAGDCVJRCOKWTN-UHFFFAOYSA-N
InChi Code
InChI=1S/C7H16N.BF4/c1-3-8(2)6-4-5-7-8;2-1(3,4)5/h3-7H2,1-2H3;/q+1;-1
Chemical Name
1-ethyl-1-methylpyrrolidin-1-ium;tetrafluoroborate
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, 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)
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
(e.g. IP/IV/IM/SC)
Injection Formulation 1: DMSO : Tween 80: Saline = 10 : 5 : 85 (i.e. 100 μL DMSO stock solution 50 μL Tween 80 850 μL Saline)
*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 : PEG300Tween 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).
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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)]
*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.
Injection Formulation 5: 2-Hydroxypropyl-β-cyclodextrin : Saline = 50 : 50 (i.e. 500 μL 2-Hydroxypropyl-β-cyclodextrin 500 μL Saline)
Injection Formulation 6: DMSO : PEG300 : castor oil : Saline = 5 : 10 : 20 : 65 (i.e. 50 μL DMSO 100 μLPEG300 200 μL castor oil 650 μL Saline)
Injection Formulation 7: Ethanol : Cremophor : Saline = 10: 10 : 80 (i.e. 100 μL Ethanol 100 μL Cremophor 800 μL Saline)
Injection Formulation 8: Dissolve in Cremophor/Ethanol (50 : 50), then diluted by Saline
Injection Formulation 9: EtOH : Corn oil = 10 : 90 (i.e. 100 μL EtOH 900 μL Corn oil)
Injection Formulation 10: EtOH : PEG300Tween 80 : Saline = 10 : 40 : 5 : 45 (i.e. 100 μL EtOH 400 μLPEG300 50 μL Tween 80 450 μL 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).
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Oral Formulation 3: Dissolved in PEG400
Oral Formulation 4: Suspend in 0.2% Carboxymethyl cellulose
Oral Formulation 5: Dissolve in 0.25% Tween 80 and 0.5% Carboxymethyl cellulose
Oral Formulation 6: Mixing with food powders


Note: Please be aware that the above formulations are for reference only. InvivoChem strongly recommends customers to read literature methods/protocols carefully before determining which formulation you should use for in vivo studies, as different compounds have different solubility properties and have to be formulated differently.

 (Please use freshly prepared in vivo formulations for optimal results.)
Preparing Stock Solutions 1 mg 5 mg 10 mg
1 mM 4.9749 mL 24.8744 mL 49.7488 mL
5 mM 0.9950 mL 4.9749 mL 9.9498 mL
10 mM 0.4975 mL 2.4874 mL 4.9749 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.
/

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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