2-undecanone

nonyl methyl ketone

CAS: 112-12-9 C11 H22 O MW: 170.29554000 fruity waxy

Identification

Name2-undecanone
IUPACundecan-2-one
CAS Number112-12-9
EINECS203-937-5
FDA UNIIYV5DSO8CY9
Molecular FormulaC11 H22 O
Molecular Weight170.29554000
MDL NumberMFCD00009583
Nikkaji NumberJ5.119E
Beilstein1749573
CoE Number150
XlogP34.10 (est)

Regulatory

JECFA Food Flavoring296 2-undecanone
DG SANTE Food Flavourings07.016 undecan-2-one
FEMA Number3093
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)112-12-9 ; 2-UNDECANONE
FDA RegulationFDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION

Physical Properties

Appearance colorless to pale yellow clear liquid (est)
Assay 98.00 to 100.00
Food Chemicals Codex Listed Yes
Specific Gravity 0.82200 to 0.82600 @ 25.00 °C.
Pounds per Gallon - (est). 6.840 to 6.873
Refractive Index 1.42800 to 1.43200 @ 20.00 °C.
Melting Point 11.00 to 14.00 °C. @ 760.00 mm Hg
Boiling Point 231.00 to 232.00 °C. @ 760.00 mm Hg, 140.00 to 141.00 °C. @ 50.00 mm Hg
Acid Value 5.00 max. KOH/g
Vapor Pressure 0.098000 mmHg @ 25.00 °C. (est)
Vapor Density 5.9 ( Air = 1 )
Flash Point 192.00 °F. TCC ( 88.89 °C. )
logP (o/w) 4.090
Shelf Life 12.00 month(s) or longer if stored properly.
Storage store in cool, dry place in tightly sealed containers, protected from heat and light.
Soluble in alcohol
Stability hair spray

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

Organoleptic Properties

Odor Strength medium
Substantivity 128 hour(s) at 100.00 %
Odor Description
at 100.00 %.
Waxy, fruity, ketonic with fatty pineapple nuances
A rose, citrus, orris-like character
chemical oily-waxy wine fruity-floral rosy citrus orris Fruity-rosy Orange-like
Odor sample from Harrmann & Reimer Corporation
Taste Description
fruity, fatty
at 30.00 ppm.
Blue cheese, winey
Blue cheese character with fatty and waxy nuances

Safety Information

Preferred SDSView
European informationMost important hazard(s):
Human Experience5% in petrolatum produced no irritation or sensitization in humans.
Oral/Parenteral Toxicityoral-mouse LD50 950 mg/kg
Dermal Toxicityskin-rabbit LD50 > 5000 mg/kg
Inhalation ToxicityNot determined

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-undecanone usage levels up to5.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU)330.00 (μg/capita/day)
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-

Advanced Biotech. Inc.

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Alfrebro LLC/ Archer Daniels Midland Company

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Associate Allied Chemicals

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Augustus Oils Ltd

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Axxence Aromatic GmbH

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Azelis UK Ltd.

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Bedoukian Research, Inc.

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Berje Inc.

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Human Chemistry

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Excellentia International

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Firmenich Inc.

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Fleurchem, Inc.

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Global Essence Inc.

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H. Interdonati, Inc.

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Indukern, S.A. F&F Ingredients Division

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Jiangyin Healthway International Trade Co., Ltd

Independent Ingredients Supplier

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Lluch Essence S.L.

A family company dedicated to sales and distribution

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M&U International LLC

Steady supply & demand

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Moellhausen S.P.A.

THE CHEMISTRY OF EMOTIONS

Innovation and commitment in the name of excellence.

View All Website +39 039.685.6262

Odowell Co.,ltd

Fulfilling Demand

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Penta International Corporation

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PerfumersWorld Ltd.

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Robertet, Inc.

HOME OF NATURE, SEED TO SCENT

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Sigma-Aldrich

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SRS Aromatics Ltd

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Synerzine, Inc.

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Potential Uses

FR agrumen aldehyde FR aldehydic FR algae FR amber FR ash mountain ash FR ash mountain ash blossom FR autumn FR bark blossom FR botanical FR boxwood FR butter FR carnation FL cheese blue cheese FL cheese cheddar cheese FR cherry black cherry FR cherry blossom FR christmas FL/FR cilantro FR clean linen FR clover FR coconut FR crabapple blossom FR dahlia FL dairy FR daisy FR daphne FR davana oil replacer dewy FR dillenia fantasy blends FR fern FR fir balsam FR floral FR flouve blossom FR freesia FR fungus FR gingergrass FR herbal FR hugonia FR lavender FR lemon FR lily FR maja FR mango flower FR musk natural FR new car FR orange FL/FR orange bitter orange peel FR orchid FR orris FR peach FR peony petal waxy petal FR pineapple FR plum blossom FR rose FR rose d'orient FR rose red rose FL/FR rue FR sap FR scented stock FR sweet pea FR tangerine FL tropical FR tulip FL/FR valerian waxy wet fields FR wisteria

Natural Occurrence

allium species banana fruit cascarilla bark oil @ 0.31% Data cayenne fruit champaca concrete @ 0.01% Data clove bud clove fruit corn husk oil croton flavens l. (welensali) leaf oil curacao @ 0.50% Data cymbopogon citratus (dc.) stapf. oil cuba @ 0.50% Data ginger rhizome ginger rhizome oil ginger root oil china @ 0.21% Data glycosmis pentaphylla (cor.) bark oil india @ 52.10% Data guava fruit hyacinthus orientalis absolute @ 0.16-0.17% Data laurel leaf oil turkey @ 0.20% Data lemongrass oil morocco @ 0.40% Data lemongrass oil yunnan @ 0.15% Data marjoram wild marjoram plant mastic fruit oil @ 2.16% Data mastic leaf oil @ 4.75% Data mastic oil @ 0.14% Data oregano plant pepper black pepper fruit pepper black pepper seed rue flower oil colombia @ 68.05% Data rue oil rue oil china @ 36.82% Data rue oil cuba @ 48.67% Data rue plant saffron stigma strawberry wild strawberry fruit sugandha kokila berry oil @ 3.60% Data zingiber officinale root oil china @ 0.71% Data

Synonyms

2- hendecanone ketone, methyl nonyl MNK methyl N-nonyl ketone methyl nonyl ketone methyl nonyl ketone (2-undecanone) methyl nonyl ketone (2-undecanone), natural methyl nonyl ketone natural methyl nonyl ketone redistilled methyl nonylketone methyl-N-nonylketone methylnonylketone nonyl methyl ketone N- nonyl methyl ketone rue ketone undecan-2-one 2-oxo undecane undecane-2-one 2- undecanone 2- undecanone (methyl nonyl ketone) natural 2- undecanone (natural) 2- undecanone natural Info: HEPTAN-2-ONE Perfumer & Flavorist: Organolpetic Characteristics of Flavor Materials US Patents: 3,952,024 - Furfurylthioacetone PubMed: Biting deterrence, repellency, and larvicidal activity of Ruta chalepensis (Sapindales: Rutaceae) essential oil and its major individual constituents against mosquitoes. Info: Volatile Flavor Components in Bogyojosaeng and Suhong Cultivars of Strawberry (Fragaria ananassa Duch.) US Patents: 3,931,166 - Certain 2,5-dimethyl-3-thiopyrazines PubMed: Wild tomato leaf extracts for spider mite and cowpea aphid control. PubMed: Monodimensional (GC-FID and GC-MS) and Comprehensive Two-dimensional Gas Chromatography for the Assessment of Volatiles and Fatty Acids from Ruta chalepensis Aerial Parts. PubMed: Characterization of novel single-variety oxygenated sesquiterpenoid hop oil fractions via headspace solid-phase microextraction and gas chromatography-mass spectrometry/olfactometry. PubMed: Production of bioactive volatiles by different Burkholderia ambifaria strains. PubMed: Bioactivity against Bursaphelenchus xylophilus: Nematotoxics from essential oils, essential oils fractions and decoction waters. PubMed: Sensitive low-pressure dielectric barrier discharge ion source. PubMed: 2-undecanone and 2-tridecanone in field-grown onion. PubMed: Repellents and acaricides as personal protection measures in the prevention of tick-borne diseases. PubMed: Efficacy of methyl nonyl ketone as an in-soil repellent for common voles (Microtus arvalis). PubMed: The repelling effect of plant secondary metabolites on water voles, Arvicola amphibius. PubMed: Characterization of novel varietal floral hop aromas by headspace solid phase microextraction and gas chromatography-mass spectrometry/olfactometry. PubMed: Synthesis of methyl ketones by metabolically engineered Escherichia coli. PubMed: Substrate mass transport in two-phase partitioning bioreactors employing liquid and solid non-aqueous phases. PubMed: Altered behavioral responses of Sindbis virus-infected Aedes aegypti (Diptera: Culicidae) to DEET and non-DEET based insect repellents. PubMed: Field evaluation of commercial repellents against the floodwater mosquito Psorophora columbiae (Diptera: Culicidae) in St. Johns County, Florida. PubMed: [Study on network compatibility of metabolisms in vivo rat for volatile oil in houttuyniae herba and 2-undecanone]. PubMed: Engineering of bacterial methyl ketone synthesis for biofuels. PubMed: Phytochemical investigation and antifeedant activity of Premna latifolia leaves. PubMed: Evaluation of antileishmanial, cytotoxic and antioxidant activities of essential oils extracted from plants issued from the leishmaniasis-endemic region of Sned (Tunisia). PubMed: Functional characterization of the octenol receptor neuron on the maxillary palps of the yellow fever mosquito, Aedes aegypti. PubMed: Aliphatic ketones from Ruta chalepensis (Rutaceae) induce paralysis on root knot nematodes. PubMed: 2-undecanone rich leaf essential oil from Zanthoxylum armatum. PubMed: Novel field assays and the comparative repellency of BioUD(®) , DEET and permethrin against Amblyomma americanum. PubMed: The effect of undecanones and their derivatives on tumor angiogenesis and VEGF content. PubMed: First report of the repellency of 2-tridecanone against ticks. PubMed: Odorant-binding proteins of the malaria mosquito Anopheles funestus sensu stricto. PubMed: [Determination of methyl nonyl ketone in volatile oil from herbs of Houttuynia cordata by GC-MS]. PubMed: Two-phase reactors applied to the removal of substituted phenols: comparison between liquid-liquid and liquid-solid systems. PubMed: Insect repellents: modulators of mosquito odorant receptor activity. PubMed: Enzymatic functions of wild tomato methylketone synthases 1 and 2. PubMed: [Comparison of volatile oils of cultivated Houttaynia cordata populations with wild]. PubMed: Olfactory response of Haematobia irritans (Diptera: Muscidae) to cattle-derived volatile compounds. PubMed: Comparative efficacy of BioUD to other commercially available arthropod repellents against the ticks Amblyomma americanum and Dermacentor variabilis on cotton cloth. PubMed: Multiple biochemical and morphological factors underlie the production of methylketones in tomato trichomes. PubMed: (S)-2-acetoxy-5-undecanone, female sex pheromone of the raspberry cane midge, Resseliella theobaldi (Barnes). PubMed: Efficacy of the new repellent BioUD against three species of ixodid ticks. PubMed: Novel arthropod repellent, BioUD, is an efficacious alternative to deet. PubMed: Biodegradation of 4-nitrophenol in a two-phase sequencing batch reactor: concept demonstration, kinetics and modelling. PubMed: Repellency property of long chain aliphatic methyl ketones against Anopheles gambiae s.s. PubMed: [Studies on expectorant compounds in volatile oil from root and rhizome of Aster tataricus]. PubMed: [Tissue distribution on methyl nonyl ketone of the volatile oil from Houttyunia cordata in mice]. PubMed: [Effects of fertilizer application on contents of 2-undecanone and soluble carbonhydrate in Houttuynia cordata with different fertilizers]. PubMed: Bioactivity and chemical composition of the leaf essential oils of Zanthoxylum rhoifolium and Zanthoxylum setulosum from Monteverde, Costa Rica. PubMed: Kinetic analysis of volatile formation in milk subjected to pressure-assisted thermal treatments. PubMed: Gas chromatographic/mass spectrometric analysis of the essential oil of Houttuynia cordata Thunb by using on-column methylation with tetramethylammonium acetate. PubMed: Analysis of leaf volatiles of Zanthoxylum gillettii used in folk medicine of Cameroon. PubMed: Studies on the alkaloid constituents of Evodia rutaecarpa (Juss) Benth var. bodinaieri (Dode) Huang and their acute toxicity in mice. PubMed: Variation in chemical composition and antibacterial activities of essential oils from two species of Houttuynia THUNB. PubMed: Biodegradation of phenol at low temperature using two-phase partitioning bioreactors. PubMed: Natural products: repellency and toxicity of wild tomato leaf extracts to the two-spotted spider mite, Tetranychus urticae Koch. PubMed: Quantitative determination of thermally derived off-flavor compounds in milk using solid-phase microextraction and gas chromatography. PubMed: Natural products: seasonal variation in trichome counts and contents in Lycopersicum hirsutum f. glabratum. PubMed: Main compounds responsible for off-odour of strawberries infected by Phytophthora cactorum. PubMed: Test of the Binding Threshold Hypothesis for olfactory receptors: explanation of the differential binding of ketones to the mouse and human orthologs of olfactory receptor 912-93. PubMed: Aroma extract dilution analysis of cv. Meeker (Rubus idaeus L.) red raspberries from Oregon and Washington. PubMed: [Analysis on yield and quality of different Houttuynia cordata]. PubMed: Analysis of ketones by selected ion flow tube mass spectrometry. PubMed: The use of Enterobacter cloacae ATCC 43560 in the development of a two-phase partitioning bioreactor for the destruction of hexahydro-1,3,5-trinitro-1,3,5-s-triazine (RDX). PubMed: Production and quantification of methyl ketones in wild tomato accessions. PubMed: High-resolution gas-chromatographic analysis of the secondary metabolites obtained by subcritical-fluid extraction from Colombian rue (Ruta graveolens L.). PubMed: Inducible P450s of the CYP9 family from larval Manduca sexta midgut. PubMed: Volatile compounds from Escherichia coli O157:H7 and their absorption by strawberry fruit. PubMed: Production of flavour ketones in aqueous-organic two-phase systems by using free and microencapsulated fungal spores as biocatalysts. PubMed: Electroantennogram and oviposition bioassay responses of Culex quinquefasciatus and Culex tarsalis (Diptera: Culicidae) to chemicals in odors from Bermuda grass infusions. PubMed: Biodegradation of phenol at high initial concentrations in two-phase partitioning batch and fed-batch bioreactors. PubMed: Characterization and optimization of a two-phase partitioning bioreactor for the biodegradation of phenol. PubMed: Expression of cytochrome P450 genes of the CYP4 family in midgut and fat body of the tobacco hornworm, Manduca sexta. PubMed: Glutathione S-transferases from larval Manduca sexta midgut: sequence of two cDNAs and enzyme induction. PubMed: Influence of life history differences of two tachinid parasitoids ofHelicoverpa zea (Boddie) (Lepidoptera: Noctuidae) on their interactions with glandular trichome/methyl ketone-based insect resistance in tomato. PubMed: Mortality and inhibition ofHelicoverpa zea Egg parasitism rates byTrichogramma in relation to trichome/methyl ketone-mediated insect resistance ofLycopersicon hirsutum f. glabratum, accession PI 134417. PubMed: Behavioral response ofTrichogramma pretiosum riley andTelenomus sphingis (Ashmead) to trichome/methyl ketone mediated resistance in tomato. PubMed: Toxicity of allelochemicals from wild insect-resistant tomatoLycopersicon hirsutum f.glabratum toCampoletis sonorensis, a parasitoid ofHeliothis zea. PubMed: Inhibition ofCampoletis sonorensis parasitism ofHeliothis zea and of parasitoid development by 2-tridecanone-mediated insect resistance of wild tomato. PubMed: Volatile methyl ketone seed-germination inhibitors fromAmaranthus palmeri S. Wats. Residues. PubMed: Activity of volatile compounds in glandular trichomes ofLycopersicon species against two insect herbivores. PubMed: Conversion of nitroheptane to dihydrojasmone. PubMed: Volatiles of Pseudomonas aeruginosa and related species by automated headspace concentration--gas chromatography. PubMed: Headspace analysis of volatile metabolites of Pseudomonas aeruginosa and related species by gas chromatography-mass spectrometry. PubMed: METHYL KETONE METABOLISM IN HYDROCARBON-UTILIZING MYCOBACTERIA.