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| Other Sizes |
| Targets |
Methyl 2-aminoisobutyrate hydrochloride does not have a defined pharmacological target as it is a biochemical reagent and amino acid derivative. The compound is used as a specific substrate of amino acid transport system and in studies on amino acid transport systems. It is often used in peptide synthesis and influences peptide behavior and stability due to its sterically bulky side chain. Its primary function is as a research tool for studying amino acid transport.
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| ln Vitro |
No specific in vitro pharmacological activity data are available for Methyl 2-aminoisobutyrate hydrochloride as it is a biochemical reagent. In research settings, the compound is used as a substrate for studying amino acid transport systems and in peptide synthesis. Its activity is assessed in terms of transport studies and peptide synthesis applications rather than direct biological activity.
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| ln Vivo |
No specific in vivo pharmacological activity data have been documented for Methyl 2-aminoisobutyrate hydrochloride as a therapeutic agent. The compound is used as a biochemical reagent and research tool. It is not administered to animals for pharmacological evaluation. Its applications are limited to amino acid transport studies and peptide synthesis research.
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| Enzyme Assay |
For non-cellular assays, Methyl 2-aminoisobutyrate hydrochloride is characterized by standard analytical techniques including NMR, HPLC, and mass spectrometry to confirm identity and purity. The compound has a molecular weight of 153.61 and formula C₅H₁₂ClNO₂. Storage: keep in a cool, dry place protected from light and moisture. The compound appears as a white solid. Purity: typically ≥98-99%.
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| Cell Assay |
For in vitro cell-based studies, Methyl 2-aminoisobutyrate hydrochloride can be used in studies on amino acid transport systems. Cells are cultured under standard conditions and treated with the compound to study amino acid uptake and transport mechanisms. The compound is typically dissolved in aqueous buffers and diluted in cell culture medium. Appropriate controls should be included in the experimental design.
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| Animal Protocol |
For in vivo animal studies, Methyl 2-aminoisobutyrate hydrochloride can be formulated using standard injection vehicles. The compound is a solid at room temperature. Dosing solutions should be freshly prepared and administered according to specific protocols with appropriate control groups. Standard handling procedures for amino acid derivatives should be followed.
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| ADME/Pharmacokinetics |
Methyl 2-aminoisobutyrate hydrochloride has a molecular weight of 153.61 and formula C₅H₁₂ClNO₂. Storage: keep in a cool, dry place protected from light and moisture. The compound appears as a white solid. Purity: typically ≥98-99%. Solubility: soluble in water and aqueous buffers. The compound is stable under recommended storage conditions.
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| Toxicity/Toxicokinetics |
Methyl 2-aminoisobutyrate hydrochloride is for research use only and not for human consumption. Standard laboratory safety practices should be followed when handling this chemical. Appropriate personal protective equipment including gloves and safety glasses should be worn. Specific LD₅₀ values and detailed toxicological profiles have not been extensively reported.
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| Additional Infomation |
See also: 2,2-Dimethyl-β-alanine (note moved to).
Methyl 2-aminoisobutyrate hydrochloride (CAS 15028-41-8) is also known as methyl α-aminoisobutyrate and 2-aminoisobutyric acid methyl ester hydrochloride. It is used as a specific substrate of amino acid transport system and in studies on amino acid transport systems. It is often used in peptide synthesis. No clinical trials or therapeutic approvals exist. |
| Molecular Formula |
C5H12CLNO2
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|---|---|
| Molecular Weight |
153.61
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| Exact Mass |
153.055
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| CAS # |
15028-41-8
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| PubChem CID |
13258034
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| Appearance |
White to off-white solid powder
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| Boiling Point |
120.6ºC at 760mmHg
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| Melting Point |
185°C
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| Flash Point |
56.1ºC
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| Vapour Pressure |
15.1mmHg at 25°C
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| LogP |
1.399
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| Hydrogen Bond Donor Count |
2
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| Hydrogen Bond Acceptor Count |
3
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| Rotatable Bond Count |
2
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| Heavy Atom Count |
9
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| Complexity |
98.6
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| Defined Atom Stereocenter Count |
0
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| SMILES |
Cl[H].O(C([H])([H])[H])C(C(C([H])([H])[H])(C([H])([H])[H])N([H])[H])=O
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| InChi Key |
NVWZNEDLYYLQJC-UHFFFAOYSA-N
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| InChi Code |
InChI=1S/C5H11NO2.ClH/c1-5(2,6)4(7)8-3;/h6H2,1-3H3;1H
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| Chemical Name |
methyl 2-amino-2-methylpropanoate;hydrochloride
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| HS Tariff Code |
2934.99.9001
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| 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)
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| 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
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| 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 | 6.5100 mL | 32.5500 mL | 65.0999 mL | |
| 5 mM | 1.3020 mL | 6.5100 mL | 13.0200 mL | |
| 10 mM | 0.6510 mL | 3.2550 mL | 6.5100 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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