Isopentyl octanoate

Name: Isopentyl octanoate
Brand: MedChemExpress
SKU: HY-W014206
Rating: 4.5 (0 reviews)

Cat. No.: HY-W014206 Purity: 99.18%: Data Sheet
COA

SDS
Handling Instructions
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Isopentyl octanoate is a class of esters formed by the esterification of branched-chain isoamyl alcohol, also known as isoamyl alcohol, with octanoylate. The compound has a fruity smell and is commonly used as a flavoring in foods such as baked goods, candy and beverages. It can also be used as a fragrance ingredient in personal care products, and as a solvent or plasticizer in various industrial applications. In addition, Isopentyl octanoate can be used as a starting material for the synthesis of other organic compounds.

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

Isopentyl octanoate Chemical Structure

CAS No. : 2035-99-6

Size	Stock	Quantity
Liquid + Solvent (Highly Recommended)
10 mM * 1 mL in DMSO ready for reconstitution	In-stock	Estimated Time of Arrival: December 31
Solution
10 mM * 1 mL in DMSO	In-stock	Estimated Time of Arrival: December 31
Liquid
100 g	In-stock	Estimated Time of Arrival: December 31
250 g	In-stock	Estimated Time of Arrival: December 31
500 g	In-stock	Estimated Time of Arrival: December 31
1 kg	In-stock	Estimated Time of Arrival: December 31

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Biological Activity
Purity & Documentation
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Description

In Vitro

Isopentyl octanoate is a biochemical reagent that can be used as a biological material or organic compound for life science related research.

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

Molecular Weight

214.35

Formula

C₁₃H₂₆O₂

CAS No.

2035-99-6

Appearance

Liquid (Density: 0.861 g/cm³)

Color

Colorless to light yellow

SMILES

CCCCCCCC(OCCC(C)C)=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:

DMSO : 100 mg/mL (466.53 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	4.6653 mL	23.3263 mL	46.6527 mL
5 mM	0.9331 mL	4.6653 mL	9.3305 mL
10 mM	0.4665 mL	2.3326 mL	4.6653 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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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

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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

Purity & Documentation

Purity: 99.18%

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Data Sheet (238 KB) SDS (393 KB)

COA (239 KB) HNMR (119 KB) GC (181 KB)

Handling Instructions (2659 KB)

Complete Stock Solution Preparation Table

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

DMSO	1 mM	4.6653 mL	23.3263 mL	46.6527 mL	116.6317 mL
	5 mM	0.9331 mL	4.6653 mL	9.3305 mL	23.3263 mL
	10 mM	0.4665 mL	2.3326 mL	4.6653 mL	11.6632 mL
	15 mM	0.3110 mL	1.5551 mL	3.1102 mL	7.7754 mL
	20 mM	0.2333 mL	1.1663 mL	2.3326 mL	5.8316 mL
	25 mM	0.1866 mL	0.9331 mL	1.8661 mL	4.6653 mL
	30 mM	0.1555 mL	0.7775 mL	1.5551 mL	3.8877 mL
	40 mM	0.1166 mL	0.5832 mL	1.1663 mL	2.9158 mL
	50 mM	0.0933 mL	0.4665 mL	0.9331 mL	2.3326 mL
	60 mM	0.0778 mL	0.3888 mL	0.7775 mL	1.9439 mL
	80 mM	0.0583 mL	0.2916 mL	0.5832 mL	1.4579 mL
	100 mM	0.0467 mL	0.2333 mL	0.4665 mL	1.1663 mL