2-acetyl furan

2-furyl methyl ketone

CAS: 1192-62-7 C6 H6 O2 MW: 110.11222000 balsamic nutty

Identification

Name2-acetyl furan
IUPAC1-(furan-2-yl)ethanone
CAS Number1192-62-7
EINECS214-757-1
FDA UNIIQ5ZRP80K02
Molecular FormulaC6 H6 O2
Molecular Weight110.11222000
MDL NumberMFCD00003242
Nikkaji NumberJ45.573C
Beilstein0107909
CoE Number11653
XlogP30.50 (est)

Regulatory

JECFA Food Flavoring1503 2-furyl methyl ketone
DG SANTE Food Flavourings13.054 2-acetylfuran
FEMA Number3163
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)1192-62-7 ; 2-FURYL METHYL KETONE

Physical Properties

Appearance colorless crystals (est)
Assay 97.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 1.10200 to 1.10700 @ 25.00 °C.
Pounds per Gallon - (est). 9.170 to 9.211
Refractive Index 1.50500 to 1.51000 @ 20.00 °C.
Melting Point 29.00 to 33.00 °C. @ 760.00 mm Hg
Boiling Point 67.00 °C. @ 10.00 mm Hg, 173.00 to 175.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.772000 mmHg @ 25.00 °C. (est)
Vapor Density 3.7 ( Air = 1 )
Flash Point 160.00 °F. TCC ( 71.11 °C. )
logP (o/w) 0.520
Soluble in alcohol
Insoluble in water

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

Organoleptic Properties

Odor Strength high ,
Substantivity > 408 hour(s) at 100.00 %
Odor Description
at 1.00 % in dipropylene glycol.
Sweet, almondy, nutty, brown and toasted with a milky, lactonic undernote
Sweet, balsamic, cereal, slight nut notes
Sweet, Cocoa, Slightly Coffee
SWEET, NUTTY, TOASTED, COFFEE
Odor sample from Sigma-Aldrich
Taste Description
at 100.00 ppm.
balsamic

Safety Information

Preferred SDSView
European informationMost important hazard(s):
Oral/Parenteral ToxicityNot determined
Dermal ToxicityNot determined
Inhalation Toxicityinhalation-rat LC50 1130 gm/M3/4hour

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryflavor and fragrance agents
RIFM Fragrance Material Safety AssessmentSearch
Recommendation for 2-acetyl furan usage levels up to0.1000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU)60.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA)13.00 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI)990 (μg/person/day)
Threshold of Concern90 (μg/person/day)
Structure ClassIII
baked goods-
beverages(nonalcoholic)-
beverages(alcoholic)-
breakfast cereal-
cheese-
chewing gum-
condiments / relishes-
confectionery froastings-
egg products-
fats / oils-
fish products-
frozen dairy-
fruit ices-
gelatins / puddings-
granulated sugar-
gravies-
hard candy-
imitation dairy-
instant coffee / tea-
jams / jellies-
meat products-
milk products-
nut products-
other grains-
poultry-
processed fruits-
processed vegetables-
reconstituted vegetables-
seasonings / flavors-
snack foods-
soft candy-
soups-
sugar substitutes-
sweet sauces-
Dairy products, excluding products of category 02.0 (01.0)1.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0)-
Edible ices, including sherbet and sorbet (03.0)-
Processed fruit (04.1)-
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2)-
Confectionery (05.0)-
Chewing gum (05.3)-
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0)1.00000
Bakery wares (07.0)5.00000
Meat and meat products, including poultry and game (08.0)3.50000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0)-
Eggs and egg products (10.0)-
Sweeteners, including honey (11.0)-
Salts, spices, soups, sauces, salads, protein products, etc. (12.0)-
Foodstuffs intended for particular nutritional uses (13.0)-
Non-alcoholic ("soft") beverages, excl. dairy products (14.1)1.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2)-
Ready-to-eat savouries (15.0)-
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0)-

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Alfrebro LLC/ Archer Daniels Midland Company

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Sigma-Aldrich

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Potential Uses

FL absinthe FR acorn FR allspice FR almond FL almond toasted almond FL amaretto FR amber FR arnica flower FR ash mountain ash FL asparagus FR azalea FR balsam FR bark FR beeswax absolute replacer FL brandy FL bread FL bread crust FL butter rum FR butterscotch FL cappuccino FR carnation FR cassia FR castoreum FL cereal FR chamomile FR cherry FR cherry black cherry FL cherry maraschino cherry FL cherry wild cherry FL chicory root FL chocolate cacao FL chocolate cocoa FR cinnamon FR coconut FR coffee FL cookie FR date FR davana oil replacer FR elder flower FR filbert FR fir balsam FR fruit FR gingerbread FR graham cracker FR graham cracker FL/FR guaiacwood FR hay new mown hay FL liver FR lychee FR malt FR maple FL meat roasted meat FL meat smoked meat FR mimosa FL molasses FR myrrh FR patchouli FR peanut FR plum FL plum greengage plum FR plum mirabelle plum FL potato baked potato FL potato fried potato FL praline FR pumpkin pie FR raisin FL sugar brown sugar FL tea FR tobacco FL tomato FL tropical FR vanilla FL/FR yerba mate FR ylang ylang

Natural Occurrence

almond roasted almond apple cooked apple PMC asparagus beef heated beef PMC beer PMC blueberry fruit brandy PMC bread wheat bread PMC cherry morello cherry PMC chestnut PMC cocoa coffee PMC guava fruit kohlrabi stem lavender oil spike spain @ 1.338% Data malpighia glabra l. fruit oil @ 2.10% Data mustard white mustard peach fruit peanut roasted peanut pepper bell pepper fruit pineapple fruit plum fruit popcorn PMC pork heated pork PMC potato baked potato raisin PMC rum PMC sesame seed strawberry wild strawberry fruit tamarind fruit oil tamarind seed oil tea black tea tea green tea tea leaf tobacco burley tobacco wine red wine yogurt

Synonyms

2- acetyl furan acetyl furan 2- acetylfuran nat.2- acetylfuran 2- acetylfuran natural 1-( furan-2-yl)ethanone 1- furan-2-ylethanone 1-(2- furanyl) ethanone 2- furyl ethanone 2- furyl methyl ketone 2- furyl methyl ketone (natural) 2- furyl methyl ketone natural 1-(2- furyl) ethanone 1-(2- furyl)ethan-1-one methyl 2-furyl ketone Info: substances containing furan substitution US Patents: 3,952,024 - Furfurylthioacetone PubMed: Characterisation of volatile compounds in a smoke flavouring from rice husk. US Patents: 3,931,166 - Certain 2,5-dimethyl-3-thiopyrazines PubMed: Alkaloids from the mangrove-derived actinomycete Jishengella endophytica 161111. PubMed: 2-acetylfuran-3-glucopyranoside as a novel marker for the detection of honey adulterated with rice syrup. PubMed: Examining of athermal effects in microwave-induced glucose/glycine reaction and degradation of polysaccharide from Porphyra yezoensis. PubMed: An efficient method for the determination of furan derivatives in apple cider and wine by solid phase extraction and high performance liquid chromatography--diode array detector. PubMed: Analytical method of free and conjugated neutral aroma components in tobacco by solvent extraction coupled with comprehensive two-dimensional gas chromatography-time-of-flight mass spectrometry. PubMed: A further tool to monitor the coffee roasting process: aroma composition and chemical indices. PubMed: Comparison of 2-acetylfuran formation between ribose and glucose in the Maillard reaction. PubMed: Two new benzofurans from Gastrodia elata and their DNA topoisomerases I and II inhibitory activities. PubMed: Spectral studies on Co(II), Ni(II) and Cu(II) complexes with thiosemicarbazone (L1) and semicarbazone (L2) derived from 2-acetyl furan. PubMed: Synthesis and antiamoebic activity of new oxime ether derivatives containing 2-acetylpyridine/2-acetylfuran. PubMed: Characterization of odor-active compounds in Californian chardonnay wines using GC-olfactometry and GC-mass spectrometry. PubMed: 2-Acetylfuran, a confounder in urinalysis for 2,5-hexanedione as an n-hexane exposure indicator. PubMed: [Acute hepatitis in subjects exposed to 2-acetylfuran and hydrazine]. PubMed: A further tool to monitor the coffee roasting process: aroma composition and chemical indices. PubMed: Short and efficient synthetic route to methyl α-trioxacarcinoside B and anomerically activated derivatives. PubMed: Thiosemicarbazone derivatives of nickel and copper: the unprecedented coordination of furan ring in octahedral nickel(II) and of triphenylphosphine in three-coordinate copper(I) complexes. PubMed: Simple and convenient approach to the Kreohnke pyridine type synthesis of functionalized indol-3-yl pyridine derivatives using 3-cyanoacetyl indole. PubMed: Comparison of 2-acetylfuran formation between ribose and glucose in the Maillard reaction. PubMed: Spectroscopic evaluation of Co(II), Ni(II) and Cu(II) complexes derived from thiosemicarbazone and semicarbazone. PubMed: Spectral studies on Co(II), Ni(II) and Cu(II) complexes with thiosemicarbazone (L1) and semicarbazone (L2) derived from 2-acetyl furan. PubMed: Synthesis, characterization, electro chemistry, catalytic and biological activities of ruthenium(III) complexes with bidentate N, O/S donor ligands. PubMed: Elemental sulfur identified in urine of cheetah, Acinonyx jubatus. PubMed: Asymmetric synthesis of methyl 6-deoxy-3-O-methyl-alpha-L-mannopyranoside from a non-carbohydrate precursor. PubMed: Synthesis and antiamoebic activity of new oxime ether derivatives containing 2-acetylpyridine/2-acetylfuran. PubMed: Characterization of odor-active compounds in Californian chardonnay wines using GC-olfactometry and GC-mass spectrometry. PubMed: Determination of furanic compounds in traditional balsamic vinegars by ion-exclusion liquid chromatography and diode-array detection. PubMed: Thermal decomposition of specifically phosphorylated D-glucoses and their role in the control of the Maillard reaction. PubMed: Acyclic stereoselection in the reaction of nucleophilic reagents with chiral N-acyliminium ions generated from N- PubMed: Metabolic reduction of novel 3,4-dichloro-5-nitrofurans in Salmonella typhimurium. PubMed: 2-Acetylfuran, a confounder in urinalysis for 2,5-hexanedione as an n-hexane exposure indicator. PubMed: Dose-dependent increase in 2,5-hexanedione in the urine of workers exposed to n-hexane. PubMed: [Acute hepatitis in subjects exposed to 2-acetylfuran and hydrazine]. PubMed: Excretion of urinary volatile metabolites in response to alloxan induced diabetes of short duration in rats. PubMed: Volatile degradation products of l-dehydroascorbic acid.