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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 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)
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| Solubility (In Vitro) |
DMSO: ~100 mg/mL (~651.0 mM; with ultrasonication)
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| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 5 mg/mL (32.55 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween-80 + 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 DMSO stock solution (50.0 mg/mL) to 400 μL of PEG300 and mix well; then add 50 μL of Tween-80 and mix well; finally add 450 μL of physiological saline and 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: ≥ 5 mg/mL (32.55 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 DMSO stock solution (50.0 mg/mL) to 900 μL of 20% SBE-β-CD saline and mix well. 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. Solubility in Formulation 3: ≥ 5 mg/mL (32.55 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 DMSO stock solution (50.0 mg/mL) to 900 μL of corn oil and mix well. (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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