propylene glycol acetone ketal
2,2,4-trimethyl-1,3-oxacyclopentane

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  2,2,4-Trimethyl-1,3-dioxolane

Name: 2,2,4-trimethyl-1,3-dioxolane CAS Number: 1193-11-9 3D/inchi ECHA EINECS - REACH Pre-Reg: 214-766-0 FDA UNII: Z0H09N14AR Nikkaji Web: J121.006H MDL: MFCD00090841 CoE Number: 11423 XlogP3-AA: 0.90 (est) Molecular Weight: 116.16004000 Formula: C6 H12 O2 BioActivity Summary: listing NMR Predictor: Predict (works with chrome, Edge or firefox) Name: (4R)-2,2,4-trimethyl-1,3-dioxolane CAS Number: 1193-11-9 (R) 3D/inchi FDA UNII: Search XlogP3-AA: 0.90 (est) Molecular Weight: 116.16004000 Formula: C6 H12 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) Name: (4S)-2,2,4-trimethyl-1,3-dioxolane CAS Number: 1193-11-9 (S) 3D/inchi FDA UNII: Search Nikkaji Web: J760.737G XlogP3-AA: 0.90 (est) Molecular Weight: 116.16004000 Formula: C6 H12 O2 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: 929 2,2,4-trimethyl-1,3-oxacyclopentane DG SANTE Food Flavourings: 06.098 2,2,4-trimethyl-1,3-dioxolane FEMA Number: 3441 2,2,4-trimethyl-1,3-oxacyclopentane FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 1193-11-9 ; 2,2,4-TRIMETHYL-1,3-OXACYCLOPENTANE   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 98.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.89900 to 0.90500 @ 25.00 °C. Pounds per Gallon - (est).: 7.481 to 7.531 Refractive Index: 1.39300 to 1.39800 @ 20.00 °C. Boiling Point: 98.00 to 99.00 °C. @ 760.00 mm Hg Acid Value: 1.00 max. KOH/g Vapor Pressure: 32.263000 mmHg @ 25.00 °C. (est) Flash Point: 66.00 °F. TCC ( 18.89 °C. ) logP (o/w): 0.999 (est) Soluble in:   alcohol   water, 111000 mg/L @ 18C (exp)   Organoleptic Properties: Odor Type: vegetable earthy ethereal green vegetable asparagus potato raw potato tomato tomato leaf Odor Description:at 100.00 %. earthy ethereal green vegetable asparagus raw potato tomato tomato leaf Luebke, William tgsc, (2009) Odor sample from: R C Treatt and Co Ltd earthy green vegetable musty potato raw potato tomato Odor Description:Earthy, green, vegetative, musty, raw potato and tomato Mosciano, Gerard P&F 21, No. 3, 51, (1996) Flavor Type: green green earthy ethereal vegetable musty tomato potato raw potato Taste Description: green earthy ethereal vegetable musty tomato raw potato Luebke, William tgsc, (2009) green earthy vegetable musty tomato potato Taste Description: at 25.00 ppm. Green, earthy, vegetative and musty with tomato and potato nuances Mosciano, Gerard P&F 21, No. 3, 51, (1996) Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: Beijing Lys Chemicals 2,2,4-Trimethyl-1,3-dioxolane BOC Sciences For experimental / research use only. 2,2,4-Trimethyl-1,3-dioxolane Endeavour Specialty Chemicals 2,2,4-Trimethyl-1,3-dioxolane 98% F&F Speciality Chemical Product Groups Kingchem Laboratories 2,2,4 TRIMETHYL 1,3 DIOXOLANE Odor: Fruity green M&U International 2,2,4-TRIMETHYL-1,3-DIOXOLANE, Kosher Penta International 2,2,4-TRIMETHYL-1,3-DIOXOLANE R C Treatt & Co Ltd 2,2,4-Trimethyl-1,3-dioxolane Halal, Kosher Robinson Brothers 2,2,4-Trimethyl-1,3-dioxolane F&F https://www.robinsonbrothers.uk/chemistry-competences Sigma-Aldrich: Aldrich For experimental / research use only. 2,2,4-Trimethyl-1,3-dioxolane sds Synerzine Acetone Propylene Glycol Acetal TCI AMERICA For experimental / research use only. 2,2,4-Trimethyl-1,3-dioxolane >98.0%(GC) sds WholeChem 2,2,4-Trimethyl-1,3-dioxolane   Safety Information: Preferred SDS: View European information : Most important hazard(s): Xi - Irritant R 10 - Flammable. R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 16 - Keep away from sources of ignition - No Smoking. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 33 - Take precautionary measures against static discharge. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.   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 propylene glycol acetone ketal usage levels up to:   not for fragrance use.   Maximised Survey-derived Daily Intakes (MSDI-EU): 0.24 (μg/capita/day) Maximised Survey-derived Daily Intakes (MSDI-USA): 0.20 (μg/capita/day) Structure Class: III 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: 8 Click here to view publication 8   average usual ppm average maximum ppm baked goods: - - beverages(nonalcoholic): - 4.00000 beverages(alcoholic): - 1.00000 breakfast cereal: - - cheese: - - chewing gum: - - condiments / relishes: - 4.00000 confectionery froastings: - 6.00000 egg products: - - fats / oils: - - fish products: - - frozen dairy: - 4.00000 fruit ices: - 4.00000 gelatins / puddings: - 4.00000 granulated sugar: - - gravies: - - hard candy: - - imitation dairy: - - instant coffee / tea: - - jams / jellies: - 2.00000 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: - -   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 64 (FGE.64): Consideration of aliphatic acyclic diols, triols, and related substances evaluated by JECFA (57th meeting) structurally related to aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 evaluated by EFSA in FGE.10Rev1 (EFSA, 2008ab) View page or View pdf EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :62384 National Institute of Allergy and Infectious Diseases:Data WISER:UN 1091 WGK Germany:1 2,2,4-trimethyl-1,3-dioxolane Chemidplus:0001193119 (4R)-2,2,4-trimethyl-1,3-dioxolane (4S)-2,2,4-trimethyl-1,3-dioxolane   References:   2,2,4-trimethyl-1,3-dioxolane NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 1193-11-9 Pubchem (cid): 62384 Pubchem (sid): 135020458   (4R)-2,2,4-trimethyl-1,3-dioxolane NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 1193-11-9 Pubchem (cid): 6997319 Pubchem (sid): 43599180   (4S)-2,2,4-trimethyl-1,3-dioxolane NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 1193-11-9 Pubchem (cid): 6992243 Pubchem (sid): 43594801   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 HMDB (The Human Metabolome Database): HMDB37266 FooDB: FDB016283 Export Tariff Code: 2932.19.5000 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these gentiana lutea root extract FL/FR balsamic balsamic bornyl formate FL/FR caramellic 2-iso butyl-3-methyl pyrazine FL/FR chocolate cocoa hexenal FL/FR citrus 2- heptanol FL/FR methyl heptenone FL/FR coconut delta- heptalactone FL/FR earthy 2- ethyl-3-methoxypyrazine FL/FR 1- nonen-3-ol FL/FR nutty pyrazine FL/FR 1- octen-3-ol FL/FR ethereal acetal FL/FR cyclohexyl formate FL/FR ethyl 4-pentenoate FL/FR ethyl formate FL/FR 1- hexen-3-ol FL/FR 2- methyl valeraldehyde FL/FR propyl formate FL/FR fatty (Z)-3- octen-1-ol FL/FR floral hexyl nonanoate FL/FR linalool oxide FL/FR octyl acetate FL/FR 2- phenyl propyl acetate FL/FR (R)- styralyl alcohol FL/FR ylang ylang flower oil III FL/FR fruity acetaldehyde dihexyl acetal FL/FR acetaldehyde diisoamyl acetal FL/FR amyl formate FL/FR ethyl (Z)-4-heptenoate FL/FR ethyl 2-ethyl acetoacetate FL/FR 2- heptyl butyrate FL/FR 2- pentyl furan FL/FR tropical thiazole FL/FR tropical trithiane FL/FR green 2-iso butyl pyrazine FL/FR 2-sec- butyl-3-methoxypyrazine FL/FR cognac heptanone FL/FR cucumber essence FL/FR cumin acetaldehyde FL/FR alpha,alpha- dimethyl benzyl alcohol FL/FR ferula galbaniflua gum extract FL/FR geranium absolute FL/FR geranium thiazole FL/FR (Z)-3- hepten-1-ol FL/FR (Z)-4- heptenal FL/FR (Z)-2- hexen-1-ol FL/FR (Z)-4- hexen-1-ol FL/FR (Z)-3- hexen-1-yl (E)-crotonate FL/FR (Z)-3- hexen-1-yl acetoacetate FL/FR (Z)-3- hexen-1-yl tiglate FL/FR 4- hexenol FL/FR octanal dimethyl acetal FL/FR 2- octen-1-ol FL/FR 1- penten-3-ol FL/FR 1- phenyl-2-pentanol FL/FR iso propyl decanoate FL/FR rose furan epoxide FL/FR tiglaldehyde FL/FR herbal 3- butylidene phthalide FL/FR 6- hydroxydihydrotheaspirane (mixture of isomers) FL/FR 1- octen-3-yl acetate FL/FR 2- pentyl acetate FL/FR thymyl methyl ether FL/FR licorice glycyrrhiza glabra root extract FL/FR melon (Z)-6- nonen-1-ol FL/FR minty iso propyl tiglate FL/FR moldy strawberry furanone methyl ether FL/FR nutty 2- acetyl-3-ethyl pyrazine FL/FR 3,6- cocoa pyrazine FL/FR 2- methyl-3-propyl pyrazine FL/FR spicy cumin seed oil FL/FR sulfurous grapefruit menthane FL/FR 3-( methyl thio) hexanol FL/FR vegetable methional FL/FR waxy octyl isobutyrate FL/FR propyl decanoate FL/FR yeasty 2- octen-4-one FL/FR For Flavor No flavor group found for these acetaldehyde 1,3-octane diol acetal FL acetaldehyde diisoamyl acetal FL/FR (E)- aconitic acid FL benzyl disulfide FL bornyl formate FL/FR 2-iso butyl pyrazine FL/FR alpha,alpha- dimethyl benzyl alcohol FL/FR ethyl 4-pentenoate FL/FR 2- ethyl-3-methoxypyrazine FL/FR 2- ethyl-4,5-dimethyl oxazole FL green pea pyrazine FL 2- heptyl butyrate FL/FR (Z)-3- hexen-1-yl (E)-crotonate FL/FR (Z)-3- hexen-1-yl acetoacetate FL/FR (E)-4- hexenal FL hexyl nonanoate FL/FR methionyl acetate FL 2- methoxy-3-propyl pyrazine FL methyl 2-(methyl thio) acetate FL 2- methyl thiazole FL 4-( methyl thio) butanol FL 2- methyl-6-propoxypyrazine FL 2- phenyl propyl acetate FL/FR propyl decanoate FL/FR iso propyl decanoate FL/FR 2-iso propyl pyridine FL 2-iso propyl-3-(methyl thio) pyrazine FL rose furan epoxide FL/FR (R)- styralyl alcohol FL/FR alliaceous alliaceous 3- mercapto-2-pentanone FL 2- methyl thioacetaldehyde FL 3- tetrahydrothiophenone FL tropical thiazole FL/FR camphoreous 6- hydroxydihydrotheaspirane (mixture of isomers) FL/FR celery 3- butylidene phthalide FL/FR citrus cognac heptanone FL/FR cocoa cocoa hexenal FL/FR creamy octyl isobutyrate FL/FR dairy 2- pentyl acetate FL/FR earthy 2- methyl-3-propyl pyrazine FL/FR 1- nonen-3-ol FL/FR panax quinquefolius root extract FL ethereal ethyl formate FL/FR fatty 2- octen-1-ol FL/FR (Z)-3- octen-1-ol FL/FR floral ylang ylang flower oil III FL/FR fruity amyl formate FL/FR ethyl (Z)-4-heptenoate FL/FR ethyl 2-ethyl acetoacetate FL/FR 2- heptanol FL/FR 1- phenyl-2-pentanol FL/FR propyl formate FL/FR tiglaldehyde FL/FR tropical trithiane FL/FR green acetaldehyde dihexyl acetal FL/FR 2-iso butyl-3-methyl pyrazine FL/FR cucumber essence FL/FR cumin acetaldehyde FL/FR cyclohexyl formate FL/FR dihydroxyacetophenone (mixed isomers) FL 2- ethyl butyraldehyde FL ferula galbaniflua gum extract FL/FR gentiana lutea root extract FL/FR geranium absolute FL/FR geranium thiazole FL/FR (Z)-3- hepten-1-ol FL/FR (E)-2- heptenal FL (Z)-4- heptenal FL/FR (Z)-4- hexen-1-ol FL/FR (Z)-2- hexen-1-ol FL/FR (Z)-3- hexen-1-yl tiglate FL/FR 1- hexen-3-ol FL/FR horseradish oil FL linalool oxide FL/FR methyl heptenone FL/FR 3- methyl pyridine FL 3-(5- methyl-2-furyl) butanal FL 2,4- octadienal FL octanal dimethyl acetal FL/FR 1- octen-3-yl acetate FL/FR 1- penten-3-ol FL/FR 2- pentyl furan FL/FR 2- propyl pyrazine FL iso propyl tiglate FL/FR lactonic delta- heptalactone FL/FR licorice glycyrrhiza glabra root extract FL/FR metallic 4- hexenol FL/FR 3-( methyl thio) hexanol FL/FR milky dextro,laevo-3-( methyl thio) butanone FL moldy strawberry furanone methyl ether FL/FR mushroom 1- octen-3-ol FL/FR musty 2- ethoxythiazole FL thymyl methyl ether FL/FR nutty acetal FL/FR 2- acetyl-3-ethyl pyrazine FL/FR aconitic acid FL 3,6- cocoa pyrazine FL/FR 2- ethyl-6-methyl pyrazine FL nutty pyrazine FL/FR onion methyl propyl disulfide FL spicy cumin seed oil FL/FR sulfurous grapefruit menthane FL/FR methyl benzyl disulfide FL potato butanone FL tomato methional FL/FR vegetable 2-sec- butyl-3-methoxypyrazine FL/FR 2- methyl valeraldehyde FL/FR 2- octen-4-one FL/FR potato butyraldehyde FL waxy (Z)-6- nonen-1-ol FL/FR octyl acetate FL/FR winey 5- ethyl-2-methyl pyridine FL   Potential Uses: FL coffee FR earth FL green FL loganberry FL potato FL tomato FL vegetable   Occurrence (nature, food, other):note   cowberry Search PMC Picture   lingonberry Search Trop Picture   tomato Search Trop Picture   Synonyms:   acetone P.G. acetal   acetone propylene glycol acetal   acetone propylene glycol ketal 1,3- dioxolane, 2,2,4-trimethyl- 2,2,4 trimethyl 1,3 dioxolane 2,2,4- trimethyl-1,3-dioxacyclopentane 2,2,4- trimethyl-1,3-dioxolane 2,2,4- trimethyl-1,3-oxacyclopentane   Articles:   None found yet. Try the PubMed Search.

Notes: Used as a food additive [EAFUS]