cocoa propanal
2-methyl-2-(methyldithio)propanal

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  67952-60-7 2-(Methyldithio)-isobutyraldehyde

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  13-55350 2-METHYL-2-(METHYLDITHIO)PROPANAL

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  Vigon International

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  Product(s):
  502098 Methyl Dithio-2-Isobutyraldehyde

Name: 2-methyl-2-methyldisulfanylpropanal CAS Number: 67952-60-7 3D/inchi ECHA EINECS - REACH Pre-Reg: 267-914-1 FDA UNII: 3D5G4AZ6L5 Nikkaji Web: J317.289I XlogP3-AA: 1.00 (est) Molecular Weight: 150.26390000 Formula: C5 H10 O S2 NMR Predictor: Predict (works with chrome, Edge or firefox) Category:flavoring agents   US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information: Google Scholar: Search Google Books: Search Google Scholar: with word "volatile" Search Google Scholar: with word "flavor" Search Google Scholar: with word "odor" Search Perfumer and Flavorist: Search Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search JECFA Food Flavoring: 580 2-methyl-2-(methyldithio)propanal DG SANTE Food Flavourings: 12.168 2-methyl-2-(methyldithio)propanal FEMA Number: 3866 2-methyl-2-(methyldithio)propanal FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 67952-60-7 ; 2-METHYL-2-(METHYLDITHIO)PROPANAL   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Melting Point: 80.00 to 83.00 °C. @ 760.00 mm Hg Boiling Point: 46.00 °C. @ 1.00 mm Hg Boiling Point: 184.00 to 185.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.744000 mmHg @ 25.00 °C. (est) Flash Point: 162.00 °F. TCC ( 72.22 °C. ) logP (o/w): 2.234 (est) Soluble in:   alcohol   oils   water, very slightly   water, 2443 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: chocolate aromatic cocoa chocolate dark chocolate chocolate tobacco Odor Description:at 0.10 % in propylene glycol. aromatic cocoa dark chocolate Flavor Type: chocolate cocoa chocolate dark chocolate chocolate Taste Description: cocoa dark chocolate Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. 2-(Methyldithio)-isobutyraldehyde Penta International 2-METHYL-2-(METHYLDITHIO)PROPANAL Vigon International Methyl Dithio-2-Isobutyraldehyde Odor: This chemical is characteristic of dark chocolate   Safety Information:   Hazards identification   Classification of the substance or mixture GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) None found. GHS Label elements, including precautionary statements   Pictogram   Hazard statement(s) None found. Precautionary statement(s) None found. Oral/Parenteral Toxicity: Not determined Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: flavoring agents Recommendation for cocoa propanal usage levels up to:   not for fragrance use.   Maximised Survey-derived Daily Intakes (MSDI-EU): ND (μg/capita/day) Structure Class: I Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS). The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library publication number: 18 Click here to view publication 18   average usual ppm average maximum ppm baked goods: 0.10000 1.00000 beverages(nonalcoholic): 0.10000 0.50000 beverages(alcoholic): - - breakfast cereal: - - cheese: - - chewing gum: - - condiments / relishes: 0.10000 0.20000 confectionery froastings: - - egg products: - - fats / oils: - - fish products: - - frozen dairy: 0.10000 0.50000 fruit ices: - - gelatins / puddings: - - granulated sugar: - - gravies: 0.10000 0.20000 hard candy: - - imitation dairy: - - instant coffee / tea: - - jams / jellies: - - meat products: 0.10000 1.00000 milk products: - - nut products: - - other grains: - - poultry: - - processed fruits: - - processed vegetables: 0.50000 5.00000 reconstituted vegetables: - - seasonings / flavors: 500.00000 500.00000 snack foods: - - soft candy: 0.10000 0.50000 soups: 0.50000 5.00000 sugar substitutes: - - sweet sauces: - -   Safety References: European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... European Food Safety Authority (EFSA) reference(s): Flavouring Group Evaluation 8 (FGE.08)[1]: Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical group 20 View page or View pdf Flavouring Group Evaluation 8, Revision 1 (FGE.08Rev1): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf Flavouring Group Evaluation 91 (FGE.91): Consideration of simple aliphatic and aromatic sulphides and thiols evaluated by JECFA (53rd and 68th meetings) structurally related to aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups evaluated by EFSA in FGE.08Rev1 (2009) View page or View pdf Scientific Opinion on Flavouring Group Evaluation 8, Revision 3 (FGE.08Rev3): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf Scientific Opinion on Flavouring Group Evaluation 08, Revision 4 (FGE.08Rev4): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30 View page or View pdf Scientific Opinion on the safety and efficacy of aliphatic and aromatic mono- and di-thiols and mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups (chemical group 20) when used as flavourings for all animal species View page or View pdf EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):67952-60-7 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :106217 National Institute of Allergy and Infectious Diseases:Data 2-methyl-2-methyldisulfanylpropanal Chemidplus:0067952607   References:   2-methyl-2-methyldisulfanylpropanal NIST Chemistry WebBook: Search Inchi Pubchem (cid): 106217 Pubchem (sid): 135063517 Flavornet: 67952-60-7   Other Information: (IUPAC): Atomic Weights of the Elements 2011 (pdf) Videos: The Periodic Table of Videos tgsc: Atomic Weights use for this web site (IUPAC): Periodic Table of the Elements FDA Substances Added to Food (formerly EAFUS): View CHEMBL: View HMDB (The Human Metabolome Database): HMDB38889 FooDB: FDB018351 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View FAO: 2-Methyl-2-(methyldithio)propanal   Potential Blenders and core components note For Odor aldehydic iso valeraldehyde FL/FR anisic methyl para-anisate FL/FR balsamic 2- acetyl furan FL/FR amyl cinnamate FL/FR iso amyl cinnamate FL/FR amyl phenyl acetate FL/FR butyl cinnamate FL/FR prenyl benzoate FL/FR caramellic fenugreek oleoresin FL/FR iso propenyl pyrazine FL/FR chocolate iso amyl phenyl acetate FL/FR iso butyl phenyl acetate FL/FR chocolate pyrazine A FL/FR chocolate tincture FL/FR cocoa hexenal FL/FR cocoa oleoresin FL/FR cocoa pentenal FL/FR 2,5- dimethyl pyrazine FL/FR 2,6- dimethyl pyrazine FL/FR 2- methoxypyrazine FL/FR tetrahydrofurfuryl phenyl acetate FL/FR 2,4,5- trimethyl thiazole FL/FR vanillyl ethyl ether FL/FR cocoa 2-iso butyl-3,5-(and 3,6)-dimethyl pyrazine FL/FR cocoa absolute FL/FR cocoa resinoid FL/FR 2- methyl butyraldehyde FL/FR coffee coffee absolute FL/FR earthy bean pyrazine FL/FR ethereal iso propyl formate FL/FR fermented 3- methyl-1-pentanol FL/FR valeraldehyde FL/FR floral alpha- amyl cinnamyl acetate FL/FR amyl salicylate FL/FR ethyl phenyl acetate FL/FR fruity butyl 2-methyl butyrate FL/FR green phenyl acetaldehyde FL/FR herbal gamma- valerolactone FL/FR honey butyl phenyl acetate FL/FR phenyl acetic acid FL/FR musty cocoa butenal FL/FR hazelnut pyrazine FL/FR naphthyl para- methyl anisole FL/FR nutty 3,6- cocoa pyrazine FL/FR 4,5- dimethyl-2-ethyl-3-thiazoline FL/FR (-)-(E,R)- filbertone FL/FR 2,6- lutidine FL/FR 2- methyl pyrazine FL/FR 2- methyl-3-ethoxypyrazine FL/FR 2,3,5,6- tetramethyl pyrazine FL/FR 2,3,5- trimethyl pyrazine FL/FR vinyl sulfurol FL/FR popcorn 2- acetyl pyrazine FL/FR roasted fenugreek resinoid FL/FR sulfurous cocoa essence FL/FR sweet vanilla oleoresin bali FL/FR vanilla ethyl vanillin isobutyrate FL/FR vanillin FL/FR vanillin propylene glycol acetal FL/FR vanillyl isobutyrate FL/FR vegetable mesityl oxide FL/FR waxy phenethyl octanoate FL/FR woody cinnamyl tiglate FL/FR For Flavor No flavor group found for these amyl phenyl acetate FL/FR bean pyrazine FL/FR butyl cinnamate FL/FR 2-iso butyl-3,5-(and 3,6)-dimethyl pyrazine FL/FR 2(4)-iso butyl-4(2),6-dimethyl dihydro-4H-1,3,5-dithiazine FL chocolate pyrazine A FL/FR cinnamyl tiglate FL/FR 4,5- dimethyl-2-ethyl thiazole FL chocolate fudge caramel flavor FL 3(2)- hydroxy-5-methyl-2(3)-hexanone FL 2- hydroxy-5-methyl-3-hexanone FL 2- methoxypyrazine FL/FR methyl para-anisate FL/FR 2- methyl-3-ethoxypyrazine FL/FR peanut dithiazine FL prenyl benzoate FL/FR 2-iso propyl-4-methyl-3-thiazoline FL pyrazines mixture FL tetrahydrofurfuryl phenyl acetate FL/FR paullinia cupana seed tincture FL aromatic aromatic amyl salicylate FL/FR balsamic amyl cinnamate FL/FR bitter cocoa pyrazines base (mixture of pyrazines) FL methyl ethoxypyrazine FL paullinia cupana seed extract FL brown fenugreek oleoresin FL/FR burnt iso propenyl pyrazine FL/FR cabbage methyl 2-thiofuroate FL caramellic caramel fudge flavor FL fenugreek resinoid FL/FR chocolate cherry chocolate fudge flavor FL chocolate FL chocolate almond fudge flavor FL chocolate banana nut flavor FL chocolate butter cream flavor FL chocolate caramel nut flavor FL chocolate chips FL chocolate coating FL chocolate cookies & cream flavor FL chocolate distillates FL chocolate essence FL chocolate europa flavor FL chocolate extract FL hot chocolate flavor FL dutch chocolate flavor FL swiss chocolate flavor FL bavarian chocolate flavor FL dark chocolate flavor FL chocolate flavor FL milk chocolate flavor FL semi sweet chocolate flavor FL german chocolate flavor FL bittersweet chocolate flavor FL mexican chocolate flavor FL abuelita chocolate flavor FL bitter chocolate flavor FL chocolate macadamia nut flavor FL chocolate marble flavor FL chocolate mousse flavor FL chocolate nibs FL chocolate raspberry creme flavor FL chocolate tincture FL/FR chocolate toffee almond flavor FL cocoa essence FL/FR cocoa oleoresin FL/FR cocoa powder distillates FL chocolate chip cookie flavor FL creme de cocoa flavor FL mocha almond fudge flavor FL mocha cream flavor FL cocoa iso butyl phenyl acetate FL/FR butyraldehyde FL chocolate enhancers FL cocoa FL cocoa absolute FL/FR cocoa bean powder FL cocoa distillates FL cocoa flavor FL cocoa hexenal FL/FR cocoa liquor FL cocoa liquor distillates FL cocoa nib distillates FL cocoa resinoid FL/FR 2- methyl furan FL theobroma cacao nib extract FL coffee coffee absolute FL/FR cookie chocolate cookie flavor FL earthy alpha- amyl cinnamyl acetate FL/FR tamarind distillates FL fatty cocoa butter distillates FL floral iso amyl cinnamate FL/FR iso amyl phenyl acetate FL/FR cocoa pentenal FL/FR phenyl acetic acid FL/FR fruity butyl 2-methyl butyrate FL/FR phenethyl octanoate FL/FR iso propyl formate FL/FR iso valeraldehyde FL/FR fusel 2- methyl butyraldehyde FL/FR green cocoa butenal FL/FR 2- ethyl butyraldehyde FL honey butyl phenyl acetate FL/FR ethyl phenyl acetate FL/FR phenyl acetaldehyde FL/FR meaty 2,6- dimethyl pyrazine FL/FR 3- mercapto-2-butanone FL musty 2,5- dimethyl pyrazine FL/FR hazelnut pyrazine FL/FR 2,3,5- trimethyl pyrazine FL/FR naphthyl para- methyl anisole FL/FR nutty 2- acetyl furan FL/FR 3,6- cocoa pyrazine FL/FR 3,5(6)- cocoa pyrazine FL 4,5- dimethyl-2-ethyl-3-thiazoline FL/FR 2,4- dimethyl-5-vinyl thiazole FL (-)-(E,R)- filbertone FL/FR 2,6- lutidine FL/FR 2- methyl pyrazine FL/FR chocolate peanut butter flavor FL 2,3,5,6- tetramethyl pyrazine FL/FR 2,4,5- trimethyl thiazole FL/FR vinyl sulfurol FL/FR phenolic propyl 2-furoate FL potato mesityl oxide FL/FR roasted 2- acetyl pyrazine FL/FR rummy vanillyl ethyl ether FL/FR spicy chocolate cinnamon hazelnut flavor FL sulfurous O- ethyl S-1-methoxyhexan-3-yl carbonothioate FL sweet vanilla oleoresin bali FL/FR tonka gamma- valerolactone FL/FR vanilla ethyl vanillin isobutyrate FL/FR vanillin FL/FR vanillin propylene glycol acetal FL/FR vanillyl isobutyrate FL/FR whiskey 3- methyl-1-pentanol FL/FR winey valeraldehyde FL/FR   Potential Uses: FL chocolate cocoa FR hay new mown hay FR tobacco   Occurrence (nature, food, other):note   found in nature   Synonyms: 2-( methydithio) isobutylraldehyde   methyl dithio-2-isobutyraldehyde 2-( methyl dithio) isobutyraldehyde alpha-( methyl dithio) isobutyraldehyde 2- methyl-2-(methyl dithio) propanal 2- methyl-2-(methyl dithio) propionaldehyde 2- methyl-2-(methyldisulfanyl)propanal 2- methyl-2-(methyldithio)propanal 2- methyl-2-(methyldithio)propanal natural dilution 2- methyl-2-(methyldithio)propionaldehyde 2- methyl-2-methyldisulfanylpropanal 2-( methyldithio)isobutyraldehyde alpha-( methyldithio)isobutyraldehyde   methylmethyldithiopropanal   propanal, 2-methyl-2-(methyldithio)-   Articles:   None found yet. Try the PubMed Search.

Notes: Meat-like flavouring for seasonings etc.