Celecoxib carboxylic acid

Cat. No.: HY-134234 Purity: 98.28%: FAQs
Data Sheet SDS COA Handling Instructions

Molarity Calculator

Celecoxib carboxylic acid is a metabolite of celecoxib (HY-14398). Celecoxib is a selective COX-2 inhibitor with an IC₅₀ of 40 nM.

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

Celecoxib carboxylic acid Chemical Structure

CAS No. : 170571-01-4

Size	Price	Stock	Quantity
5 mg	USD 260	In-stock	Estimated Time of Arrival: December 31
10 mg	USD 400	In-stock	Estimated Time of Arrival: December 31
50 mg		Get quote
100 mg		Get quote

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Description

Celecoxib carboxylic acid is a metabolite of celecoxib (HY-14398). Celecoxib is a selective COX-2 inhibitor with an IC₅₀ of 40 nM^[1].

Molecular Weight

411.36

Formula

C₁₇H₁₂F₃N₃O₄S

CAS No.

170571-01-4

Appearance

Solid

Color

White to off-white

SMILES

O=C(O)C1=CC=C(C2=CC(C(F)(F)F)=NN2C3=CC=C(S(=O)(N)=O)C=C3)C=C1

Shipping

Room temperature in continental US; may vary elsewhere.

Storage

4°C, sealed storage, away from moisture

*In solvent : -80°C, 6 months; -20°C, 1 month (sealed storage, away from moisture)

Solvent & Solubility

In Vitro:

DMSO : 125 mg/mL (303.87 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	2.4310 mL	12.1548 mL	24.3096 mL
5 mM	0.4862 mL	2.4310 mL	4.8619 mL
10 mM	0.2431 mL	1.2155 mL	2.4310 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 (sealed storage, away from moisture). 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

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Calculation results:

Working solution concentration: mg/mL

Purity & Documentation

Purity: 98.28%

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Data Sheet (274 KB) SDS (398 KB)

COA (257 KB) HNMR (288 KB) RP-HPLC (246 KB) MS (68 KB)

Handling Instructions (2659 KB)

References

[1]. Kim SH, et al. Effects of CYP2C9 genetic polymorphisms on the pharmacokinetics of celecoxib and its carboxylic acid metabolite. Arch Pharm Res. 2017 Mar;40(3):382-390. [Content Brief]

Complete Stock Solution Preparation Table

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

DMSO	1 mM	2.4310 mL	12.1548 mL	24.3096 mL	60.7740 mL
	5 mM	0.4862 mL	2.4310 mL	4.8619 mL	12.1548 mL
	10 mM	0.2431 mL	1.2155 mL	2.4310 mL	6.0774 mL
	15 mM	0.1621 mL	0.8103 mL	1.6206 mL	4.0516 mL
	20 mM	0.1215 mL	0.6077 mL	1.2155 mL	3.0387 mL
	25 mM	0.0972 mL	0.4862 mL	0.9724 mL	2.4310 mL
	30 mM	0.0810 mL	0.4052 mL	0.8103 mL	2.0258 mL
	40 mM	0.0608 mL	0.3039 mL	0.6077 mL	1.5194 mL
	50 mM	0.0486 mL	0.2431 mL	0.4862 mL	1.2155 mL
	60 mM	0.0405 mL	0.2026 mL	0.4052 mL	1.0129 mL
	80 mM	0.0304 mL	0.1519 mL	0.3039 mL	0.7597 mL
	100 mM	0.0243 mL	0.1215 mL	0.2431 mL	0.6077 mL