Benzoic acid-d₅

Name: Benzoic acid-d 5
Brand: MedChemExpress
SKU: HY-N0216S
Rating: 4.5 (1 reviews)

Cat. No.: HY-N0216S Purity: 99.16%: FAQs
Data Sheet SDS COA Handling Instructions

Molarity Calculator

Benzoic acid-d₅ is a deuterium substitute for Benzoic acid. Benzoic acid is an aromatic alcohol that occurs naturally in many plants and is a common additive in food, beverages, cosmetics and other products. Benzoic acid can act as a preservative by inhibiting bacteria and fungi[1][2].

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

Benzoic acid-d<sub>5</sub> Chemical Structure

Benzoic acid-d₅ Chemical Structure

CAS No. : 1079-02-3

Size	Price	Stock	Quantity
Free Sample (0.1 - 0.5 mg)		Apply Now
50 mg	USD 30	In-stock	Estimated Time of Arrival: December 31
100 mg	USD 50	In-stock	Estimated Time of Arrival: December 31
200 mg		Get quote
500 mg		Get quote

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Based on 1 publication(s) in Google Scholar

Other Forms of Benzoic acid-d₅:

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Biological Activity
Purity & Documentation
References
Customer Review

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].
Benzoic acid-d5 can be used for labeling and quantifying the glycopeptides of human serum IgG (hIgG)^[3].

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

Molecular Weight

127.15

Formula

C₇HD₅O₂

CAS No.

1079-02-3

Appearance

Solid

Color

White to off-white

SMILES

O=C(O)C1=C([2H])C([2H])=C([2H])C([2H])=C1[2H]

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

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

Solvent & Solubility

In Vitro:

DMSO : 125 mg/mL (983.09 mM; Need ultrasonic; Hygroscopic DMSO has a significant impact on the solubility of product, please use newly opened DMSO)

Preparing
Stock Solutions

Concentration Solvent Mass	1 mg	5 mg	10 mg

1 mM	7.8647 mL	39.3236 mL	78.6473 mL
5 mM	1.5729 mL	7.8647 mL	15.7295 mL
10 mM	0.7865 mL	3.9324 mL	7.8647 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.

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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

In Vivo Dissolution Calculator

Please enter the basic information of animal experiments:

Dosage

mg/kg

Animal weight
(per animal)

Dosing volume
(per animal)

μL

Number of animals

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

Calculation results:

Working solution concentration: mg/mL

Purity & Documentation

Purity: 99.16%

Select Batch:

Data Sheet (275 KB) SDS (580 KB)

COA (252 KB) LCMS (89 KB)

Handling Instructions (2659 KB)

References

[1]. Edward M Russak, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. doi: 10.1177/1060028018797110. Epub 2018 Aug 23. [Content Brief]

[2]. Nair B, et al. Final report on the safety assessment of Benzyl Alcohol, Benzoic Acid, and Sodium Benzoate. Int J Toxicol. 2001;20 Suppl 3:23-50. [Content Brief]

[3]. Masaki Kurogochi, et al. Relative quantitation of glycopeptides based on stable isotope labeling using MALDI-TOF MS. Molecules. 2014 Jul 9;19(7):9944-61. [Content Brief]

Complete Stock Solution Preparation Table

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

DMSO	1 mM	7.8647 mL	39.3236 mL	78.6473 mL	196.6182 mL
	5 mM	1.5729 mL	7.8647 mL	15.7295 mL	39.3236 mL
	10 mM	0.7865 mL	3.9324 mL	7.8647 mL	19.6618 mL
	15 mM	0.5243 mL	2.6216 mL	5.2432 mL	13.1079 mL
	20 mM	0.3932 mL	1.9662 mL	3.9324 mL	9.8309 mL
	25 mM	0.3146 mL	1.5729 mL	3.1459 mL	7.8647 mL
	30 mM	0.2622 mL	1.3108 mL	2.6216 mL	6.5539 mL
	40 mM	0.1966 mL	0.9831 mL	1.9662 mL	4.9155 mL
	50 mM	0.1573 mL	0.7865 mL	1.5729 mL	3.9324 mL
	60 mM	0.1311 mL	0.6554 mL	1.3108 mL	3.2770 mL
	80 mM	0.0983 mL	0.4915 mL	0.9831 mL	2.4577 mL
	100 mM	0.0786 mL	0.3932 mL	0.7865 mL	1.9662 mL