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10032-13-0

Hexyl isovalerate Standard for GC, also known as Hexyl 3-Methylbutyrate, is an organic compound with a distinct odor reminiscent of unripe fruit. It is primarily used in the perfumery industry for its earthy and tobacco notes. HEXYL ISOVALERATE STANDARD FOR GC can be synthesized through the esterification of n-hexanol with isovaleric acid. It is also found naturally in various fruits, vegetables, and beverages, contributing to their unique taste and aroma profiles.

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  • 10032-13-0 Structure

  • Basic information

    1. Product Name: HEXYL ISOVALERATE STANDARD FOR GC
    2. Synonyms: 3-methyl-butanoicacihexylester;3-methylbutyricacidhexylester;Butanoicacid,3-methyl-,hexylester;hexyl 3-methylbutyrate;isovalericacid,hexylester;n-Hexyl iso-valerate;n-hexylisopentanoate;HEXYL 3-METHYLBUTANOATE 99+%
    3. CAS NO:10032-13-0
    4. Molecular Formula: C11H22O2
    5. Molecular Weight: 186.29118
    6. EINECS: 233-105-7
    7. Product Categories: Alpha Sort;Chemical Class;E-LAnalytical Standards;EstersAlphabetic;H;HA -HT;Volatiles/ Semivolatiles;Alphabetical Listings;Flavors and Fragrances;G-H
    8. Mol File: 10032-13-0.mol

  • Chemical Properties

    1. Melting Point: -63.1°C (estimate)
    2. Boiling Point: 215 °C(lit.)
    3. Flash Point: 190 °F
    4. Appearance: Colorless liquid with fruitee
    5. Density: 0.857 g/mL at 25 °C(lit.)
    6. Vapor Pressure: 0.158mmHg at 25°C
    7. Refractive Index: n20/D 1.419
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: HEXYL ISOVALERATE STANDARD FOR GC(CAS DataBase Reference)
    11. NIST Chemistry Reference: HEXYL ISOVALERATE STANDARD FOR GC(10032-13-0)
    12. EPA Substance Registry System: HEXYL ISOVALERATE STANDARD FOR GC(10032-13-0)

  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany: 2
    5. RTECS: EK7908500
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 10032-13-0(Hazardous Substances Data)

10032-13-0 Usage

Uses

Used in Perfumery:
Hexyl isovalerate Standard for GC is used as a fragrance ingredient in the perfumery industry for its earthy and tobacco notes, adding depth and complexity to scent compositions.
Used in Flavor and Fragrance Industry:
Hexyl isovalerate Standard for GC is used as a flavoring agent in the flavor and fragrance industry, providing green, fruity, apple, and meaty notes with ripe, waxy pear nuances. It is commonly found in the natural aroma of banana, bell pepper, spearmint and other mint oils, cider, white wine, sparkling wine, yellow passion fruit, cherimoya, nectarines, and lamb's lettuce.
Used in Analytical Chemistry:
Hexyl isovalerate Standard for GC is used as a reference material in gas chromatography (GC) for the identification, quantification, and quality control of this compound in various samples, including perfumes, flavors, and fragrances.
Used in Research and Development:
Hexyl isovalerate Standard for GC is utilized in research and development for the study of its chemical properties, synthesis methods, and potential applications in different industries, such as the development of new fragrances or flavors.

Preparation

By esterification of n-hexanol with isovaleric acid

Check Digit Verification of cas no

The CAS Registry Mumber 10032-13-0 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,0,0,3 and 2 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 10032-13:
(7*1)+(6*0)+(5*0)+(4*3)+(3*2)+(2*1)+(1*3)=30
30 % 10 = 0
So 10032-13-0 is a valid CAS Registry Number.
InChI:InChI=1/C11H22O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h10H,4-9H2,1-3H3

10032-13-0SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name HEXYL ISOVALERATE STANDARD FOR GC

1.2 Other means of identification

Product number -
Other names Isovaleriansaeure-hexylester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only. Food additives -> Flavoring Agents
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:10032-13-0 SDS

10032-13-0Downstream Products

10032-13-0Relevant articles and documents

Structure-function correlation in lipase catalysed esterification reactions of short and medium carbon chain length alcohols and acids

Divakar, Soundar

, p. 1919 - 1922 (2007/10/03)

An attempt has been made to correlate the carbon chain lengths of acids and alcohols to the extent of esterification in the Rhizomucor miehei lipase catalyzed esterification reactions involving acids of carbon chain length C2-C5 and alcohols of carbon chain length C1-C8.

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