2-Octanone

ALDRICH/W280208 - ≥98%, FG

Synonym: Hexyl methyl ketone

CAS Number: 111-13-7
Empirical Formula (Hill Notation): C₈H₁₆O
Molecular Weight: 128.21
EC Number: 203-837-1
MDL Number: MFCD00009540
Linear Formula: CH₃(CH₂)₅COCH₃
Product Type: Chemical

Catalog Number	PKG Qty.	Price


45-W280208-1KG-K	1 kg	$76.30 1/EA	Add To Favorites
45-W280208-4KG-K	4 kg	$283.00 1/EA	Add To Favorites
45-W280208-20KG-K	20 kg	$525.00 1/EA	Add To Favorites
45-W280208-SAMPLE-K		$54.60 1/EA	Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

agency	follows IFRA guidelines
	meets purity specifications of JECFA
application(s)	flavors and fragrances
assay	≥98%
biological source	synthetic
bp	173 °C (lit.)
density	0.819 g/mL at 25 °C (lit.)
documentation	see Safety & Documentation for available documents
food allergen	no known allergens
fragrance allergen	no known allergens
grade	FG
	Fragrance grade
	Halal
	Kosher
InChI	1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3
InChI key	ZPVFWPFBNIEHGJ-UHFFFAOYSA-N
mp	−16 °C (lit.)
organoleptic	woody; earthy; herbaceous
Quality Level	400
refractive index	n20/D 1.416 (lit.)
reg. compliance	EU Regulation 1223/2009
	EU Regulation 1334/2008 & 872/2012
SMILES string	CCCCCCC(C)=O

Application:	• A novel coupling technique based on thermal desorption gas chromatography with mass spectrometry and ion mobility spectrometry for breath analysis.: This study introduces a new method for analyzing breath by coupling thermal desorption gas chromatography with mass spectrometry and ion mobility spectrometry. The method enhances the detection of volatile organic compounds, including 2-Octanone, which has potential applications in medical diagnostics (Schanzmann et al., 2023 ). A Lifetime of a Dispenser-Release Rates of Olive Fruit Fly-Associated Yeast Volatile Compounds and Their Influence on Olive Fruit Fly (Bactrocera oleae Rossi) Attraction.: The research examines the release rates of volatile compounds, including 2-Octanone, from yeast associated with olive fruit flies. These findings are significant for developing effective pest management strategies in agriculture (Veršić Bratinčević et al., 2023 ). Identification of volatile organic compounds related to the eating quality of cooked japonica rice.: This study identifies volatile organic compounds, including 2-Octanone, that contribute to the eating quality of cooked japonica rice. The findings provide insights for the food industry to enhance rice flavor and quality (Lee et al., 2022 ).
General description:	2-Octanone is a volatile flavor compound reported to be found in blue cheese, acerola fruit, blue crab and cray fish.
Packaging:	1, 2.5 kg in glass bottle
Packaging:	20 kg in composite drum
Packaging:	4 kg in steel drum
Packaging:	800 g in glass bottle

Symbol	GHS02,GHS07
Signal word	Warning
Hazard statements	H226 - H312
Precautionary statements	P210 - P233 - P240 - P241 - P280 - P303 + P361 + P353
Hazard Codes	Xn
Risk Statements	21
Safety Statements	36/37
RIDADR	UN1224 - class 3 - PG 3 - Ketones, liquid, n.o.s., HI: all
WGK Germany	WGK 1
Flash Point(F)	132.8 °F - closed cup
Flash Point(C)	56 °C - closed cup

Purity	≥98%
bp	173 °C (lit.)
mp	−16 °C (lit.)
Density	0.819 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.416 (lit.)
FEMA Number	2802
UNSPSC	12164502

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