Ethyl acetoacetate-d₅ (Synonyms: Ethyl acetylacetate-d₅)

Cat. No.: HY-Y1093S2 Purity: 99.22%: FAQs
Data Sheet SDS COA Handling Instructions Technical Support

Ethyl acetoacetate-d₅ is the deuterium labeled Ethyl acetoacetate[1]. Ethyl acetoacetate (Ethyl acetylacetate) is an ester widely used as an intermediate in the synthesis of many varieties of compounds[2][3][4]. Ethyl acetoacetate is an inhibitor of bacterial biofilm[5].

For research use only. We do not sell to patients.

Ethyl acetoacetate-d<sub>5</sub> Chemical Structure

Ethyl acetoacetate-d₅ Chemical Structure

CAS No. : 55514-60-8

Size	Stock	Quantity
5 mg	In-stock	Estimated Time of Arrival: December 31
10 mg	In-stock	Estimated Time of Arrival: December 31
25 mg	In-stock	Estimated Time of Arrival: December 31
50 mg	In-stock	Estimated Time of Arrival: December 31
100 mg	Get quote
200 mg	Get quote

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Other Forms of Ethyl acetoacetate-d₅:

Ethyl acetoacetate Get quote

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Description

In Vitro

Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs^[1].

MedChemExpress (MCE) has not independently confirmed the accuracy of these methods. They are for reference only.

Molecular Weight

135.17

Formula

C₆H₅D₅O₃

CAS No.

55514-60-8

Appearance

Liquid

Color

Colorless to light yellow

SMILES

[2H]C([2H])([2H])C(C([2H])([2H])C(OCC)=O)=O

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

Pure form	-20°C	3 years
	4°C	2 years
In solvent	-80°C	6 months
	-20°C	1 month

Solvent & Solubility

In Vitro:

H₂O : 50 mg/mL (369.90 mM; Need ultrasonic)

Preparing
Stock Solutions

Concentration Solvent Mass	1 mg	5 mg	10 mg

1 mM	7.3981 mL	36.9905 mL	73.9809 mL
5 mM	1.4796 mL	7.3981 mL	14.7962 mL
10 mM	0.7398 mL	3.6990 mL	7.3981 mL

View the Complete Stock Solution Preparation Table

* Please refer to the solubility information to select the appropriate solvent. Once prepared, please aliquot and store the solution to prevent product inactivation from repeated freeze-thaw cycles.
Storage method and period of stock solution: -80°C, 6 months; -20°C, 1 month. When stored at -80°C, please use it within 6 months. When stored at -20°C, please use it within 1 month.

* Note: If you choose water as the stock solution, please dilute it to the working solution, then filter and sterilize it with a 0.22 μm filter before use.

Molarity Calculator
Dilution Calculator

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)

In Vivo Dissolution Calculator

Please enter the basic information of animal experiments:

Dosage

mg/kg

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(per animal)

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Recommended: Prepare an additional quantity of animals to account for potential losses during experiments.

Calculation results:

Working solution concentration: mg/mL

This product has good water solubility, please refer to the measured solubility data in water/PBS/Saline for details.

The concentration of the stock solution you require exceeds the measured solubility. The following solution is for reference only.If necessary, please contact MedChemExpress (MCE).

Purity & Documentation

Purity: 99.22%

Select Batch:

Data Sheet (273 KB) SDS (251 KB)

COA (248 KB) HNMR (544 KB) GC (1329 KB)

Handling Instructions (2659 KB)

References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. [Content Brief]

[2]. Rao M.Uppu, et al. Enantioselective catalytic asymmetric hydrogenation of ethyl acetoacetate in room temperature ionic liquids. Biochemical and Biophysical Research Communications. 1996 Dec; 229(3):764-769.

[3]. Leo F. Salter, et al. A dual‐frequency Belousov Zhabotinskii oscillating reaction with ethyl acetoacetate as organic substrate. substrate. International Journal of Chemical Kinetics. 1982. 14(8), 815–821.

[4]. Iqbal S, et al. 2-Oxo-1,2,3,4-tetrahydropyrimidines Ethyl Esters as Potent β- Glucuronidase Inhibitors: One-pot Synthesis, In vitro and In silico Studies. Med Chem. 201814(8):818-830. [Content Brief]

[5]. Horne SM, et al. Acetoacetate and ethyl acetoacetate as novel inhibitors of bacterial biofilm. Lett Appl Microbiol. 2018 Apr66(4):329-339. [Content Brief]

Complete Stock Solution Preparation Table

Optional Solvent	Concentration Solvent Mass	1 mg	5 mg	10 mg	25 mg

H₂O	1 mM	7.3981 mL	36.9905 mL	73.9809 mL	184.9523 mL
	5 mM	1.4796 mL	7.3981 mL	14.7962 mL	36.9905 mL
	10 mM	0.7398 mL	3.6990 mL	7.3981 mL	18.4952 mL
	15 mM	0.4932 mL	2.4660 mL	4.9321 mL	12.3302 mL
	20 mM	0.3699 mL	1.8495 mL	3.6990 mL	9.2476 mL
	25 mM	0.2959 mL	1.4796 mL	2.9592 mL	7.3981 mL
	30 mM	0.2466 mL	1.2330 mL	2.4660 mL	6.1651 mL
	40 mM	0.1850 mL	0.9248 mL	1.8495 mL	4.6238 mL
	50 mM	0.1480 mL	0.7398 mL	1.4796 mL	3.6990 mL
	60 mM	0.1233 mL	0.6165 mL	1.2330 mL	3.0825 mL
	80 mM	0.0925 mL	0.4624 mL	0.9248 mL	2.3119 mL
	100 mM	0.0740 mL	0.3699 mL	0.7398 mL	1.8495 mL

* Note: If you choose water as the stock solution, please dilute it to the working solution, then filter and sterilize it with a 0.22 μm filter before use.

Ethyl acetoacetate-d₅ Related Classifications

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Help & FAQs

Do most proteins show cross-species activity?
Species cross-reactivity must be investigated individually for each product. Many human cytokines will produce a nice response in mouse cell lines, and many mouse proteins will show activity on human cells. Other proteins may have a lower specific activity when used in the opposite species.

Keywords:

Ethyl acetoacetate-d₅55514-60-8Ethyl acetylacetate-d₅BacterialInhibitorinhibitorinhibit

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Ethyl acetoacetate-d5 (Synonyms: Ethyl acetylacetate-d5)

Other Forms of Ethyl acetoacetate-d5:

Ethyl acetoacetate-d5 Related Antibodies

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Ethyl acetoacetate-d5 Related Antibodies

Molarity Calculator

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Complete Stock Solution Preparation Table

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