yingweiwo

4-(Methylhydroxyphosphinyl)-2-oxobutyric acid

Cat No.:V60051 Purity: ≥98%
4-(Methylhydroxyphosphinyl)-2-oxobutyric acid
4-(Methylhydroxyphosphinyl)-2-oxobutyric acid Chemical Structure CAS No.: 79778-02-2
Product category: Others 8
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
100mg
250mg
Official Supplier of:
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text
Alternate Text

 

  • Business Relationship with 5000+ Clients Globally
  • Major Universities, Research Institutions, Biotech & Pharma
  • Citations by Top Journals: Nature, Cell, Science, etc.
Top Publications Citing lnvivochem Products
Product Description
4-(Methylhydroxyphosphinyl)-2-oxobutyric acid (CAS 79778-02-2) is a chemical compound with the molecular formula C₅H₉O₅P and a molecular weight of 180.1 g/mol. It is also known as 4-(Hydroxy(methyl)phosphoryl)-2-oxobutanoic acid. The compound contains a phosphinic acid functional group and is classified as an organic phosphorus compound. It is used in pharmaceutical research and development.
Biological Activity I Assay Protocols (From Reference)
Targets
The specific molecular targets of 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid are not well characterized in the available literature. The compound contains a phosphinic acid group, which is a structural feature found in various enzyme inhibitors, particularly those targeting metalloproteases and other enzymes that utilize phosphoryl transfer reactions. The compound may serve as a chemical intermediate or building block for the synthesis of bioactive compounds.
ln Vitro
Specific in vitro activity data for 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid are not reported in the available literature. The compound is primarily used as a chemical intermediate or research reagent rather than as a pharmacologically active agent. Its biological activity, if any, would depend on the specific context of use. The compound is classified under "Others" in chemical databases, indicating limited characterization of its biological properties.
ln Vivo
Specific in vivo data for 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid are not reported. The compound is not described as a therapeutic agent but rather as a chemical building block or research reagent. No in vivo studies have been reported in the available literature.
Enzyme Assay
The characterization of 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid is performed using standard analytical chemistry methods. The compound is analyzed by HPLC for purity (typically ≥98%) and by mass spectrometry for molecular weight confirmation. NMR spectroscopy may be used for structural confirmation. No specific biological assay protocols are reported for this compound.
Cell Assay
No specific cellular assay protocols for 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid are reported in the available literature. The compound is not typically used in cell-based assays as it is a chemical intermediate rather than a biologically active compound. If used in research, standard cell culture protocols would apply depending on the specific application. The compound has a molecular weight of 180.1 g/mol.
Animal Protocol
No specific in vivo animal protocols for 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid are reported in the available literature. The compound is not a therapeutic agent and is not typically used in animal studies.
ADME/Pharmacokinetics
Specific pharmacokinetic data for 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid are not reported. The compound has a molecular weight of 180.1 g/mol and a molecular formula of C₅H₉O₅P. Its small size and polar nature suggest it may have reasonable water solubility. The compound is typically stored at room temperature or as specified by the manufacturer.
Toxicity/Toxicokinetics
Specific toxicological data for 4-(Methylhydroxyphosphinyl)-2-oxobutyric acid are not reported. As a chemical intermediate, comprehensive toxicology studies have not been performed. The compound should be handled with appropriate safety precautions in laboratory settings, including the use of gloves, eye protection, and proper ventilation. Material safety data sheets should be consulted for detailed safety information.
Additional Infomation
4-(Methylhydroxyphosphinyl)-2-oxobutyric acid is a chemical compound with the molecular formula C₅H₉O₅P and a molecular weight of 180.1 g/mol. It is used in pharmaceutical research and development. No biological activity or clinical applications have been reported. For research use only.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C5H9O5P
Molecular Weight
180.1
Exact Mass
179.011
CAS #
79778-02-2
PubChem CID
22328393
Appearance
Typically exists as solid at room temperature
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
5
Heavy Atom Count
11
Complexity
187
Defined Atom Stereocenter Count
0
SMILES
OCP(CCC(=O)C(O)=O)=O
HS Tariff Code
2934.99.9001
Storage

Powder      -20°C    3 years

                     4°C     2 years

In solvent   -80°C    6 months

                  -20°C    2 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 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).
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)]
*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).
View More

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 5.5525 mL 27.7624 mL 55.5247 mL
5 mM 1.1105 mL 5.5525 mL 11.1049 mL
10 mM 0.5552 mL 2.7762 mL 5.5525 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.)
+
+
+

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.

Contact Us