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W337609

4-Methylthio-4-methyl-2-pentanone

Name: 4-Methylthio-4-methyl-2-pentanone
Brand: ALDRICH

≥98%, FG

Synonym(s):

cassis pentanone

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About This Item

Linear Formula:

CH₃SC(CH₃)₂CH₂COCH₃

CAS Number:

23550-40-5

Molecular Weight:

146.25

FEMA Number:

3376

Council of Europe no.:

11551

UNSPSC Code:

12164502

PubChem Substance ID:

24901675

Flavis number:

12.058

EC Number:

245-727-6

NACRES:

NA.21

MDL number:

MFCD00049253

Organoleptic:

green; metallic; sulfurous

Grade:

FG, Halal, Kosher

Biological source:

synthetic

Food allergen:

no known allergens

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Properties

biological source

synthetic

Quality Level

300, 400

grade

FG, Halal, Kosher

reg. compliance

EU Regulation 1334/2008 & 872/2012, FDA 21 CFR 110

assay

≥98%

refractive index

n20/D 1.472 (lit.)

bp

78 °C/15 mmHg (lit.)

density

0.964 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

green; metallic; sulfurous

SMILES string

CSC(C)(C)CC(C)=O

InChI

1S/C7H14OS/c1-6(8)5-7(2,3)9-4/h5H2,1-4H3

InChI key

DHANVOSHQILVNQ-UHFFFAOYSA-N

Description

General description

4-Methylthio-4-methyl-2-pentanone is a volatile sulfur-containing flavor compound found in white wines.

Application

Optimization of ultrasound assisted-emulsification-dispersive liquid-liquid microextraction by experimental design methodologies for the determination of sulfur compounds in wines by gas chromatography-mass spectrometry.: This paper discusses the optimization of a novel extraction technique using 4-Methylthio-4-methyl-2-pentanone for identifying sulfur compounds in wines. The methodology enhances the detection capabilities of gas chromatography-mass spectrometry, offering significant improvements in food safety and quality control (Silva MF et al., 2010).

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

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Global Trade Item Number

SKU	GTIN
W337609-25G-K	04061837890642
W337609-SAMPLE-K	04061837890659
W337609-100G-K	04061837890628
W337609-1KG-K	04061837890635