acetaldehyde butyl phenethyl acetal
1-butoxy-1-(2-phenylethoxy)ethane

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  64577-91-9 2-Butoxy-2-phenylethoxyethane 95%

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Name: 2-(1-butoxyethoxy)ethylbenzene CAS Number: 64577-91-9 3D/inchi ECHA EINECS - REACH Pre-Reg: 264-948-9 FDA UNII: KZ6JI8OWWE Nikkaji Web: J307.253C CoE Number: 10007 XlogP3-AA: 3.70 (est) Molecular Weight: 222.32774000 Formula: C14 H22 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) EFSA/JECFA Comments: Racemate. Category:flavor and fragrance 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: 1001 acetaldehyde butyl phenethyl acetal DG SANTE Food Flavourings: 06.036 1-butoxy-1-(2-phenylethoxy)ethane FEMA Number: 3125 acetaldehyde butyl phenethyl acetal FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 64577-91-9 ; ACETALDEHYDE, BUTYL PHENETHYL ACETAL   Physical Properties: Appearance: colorless clear liquid (est) Assay: 97.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.92300 to 0.93500 @ 25.00 °C. Pounds per Gallon - (est).: 7.680 to 7.780 Refractive Index: 1.46700 to 1.48100 @ 20.00 °C. Boiling Point: 280.00 to 282.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.007000 mmHg @ 25.00 °C. (est) Flash Point: 195.00 °F. TCC ( 90.60 °C. ) (est) logP (o/w): 3.549 (est) Soluble in:   alcohol   water, 15.78 mg/L @ 25 °C (est) Insoluble in:   water Stability:   alkalis   Organoleptic Properties: Odor Type: green green leafy vegetable Odor Description:at 100.00 %. green leafy vegetable Flavor Type: green pepper bell pepper green vegetable Taste Description: green pepper Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: BOC Sciences For experimental / research use only. 2-Butoxy-2-phenylethoxyethane 95% Parchem acetaldehyde butyl phenethyl acetal Chemical Sources Association Need This Item for Flavor/Food?: You can contact the Chemical Sources Association   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: flavor and fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice Recommendation for acetaldehyde butyl phenethyl acetal usage levels up to:   0.5000 % in the fragrance concentrate.   Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day) Maximised Survey-derived Daily Intakes (MSDI-USA): 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: 4 Click here to view publication 4   average usual ppm average maximum ppm baked goods: - - beverages(nonalcoholic): - 5.00000 beverages(alcoholic): - - breakfast cereal: - - cheese: - - chewing gum: - 5.00000 condiments / relishes: - - confectionery froastings: - - egg products: - - fats / oils: - - fish products: - - frozen dairy: - 5.00000 fruit ices: - 5.00000 gelatins / puddings: - 5.00000 granulated sugar: - - gravies: - - hard candy: - 5.00000 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: - -   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): Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to: Flavouring Group Evaluation 14 (FGE.14): Phenethyl alcohol, aldehyde, esters, and related phenylacetic acid esters from chemical group 15 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf Flavouring Group Evaluation 53 (FGE.53): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) structurally related to phenethyl alcohol, aldehyde, esters and related phenylacetic acid esters evaluated by EFSA in FGE.14 (2005) and one phenoxyethyl ester evaluated in FGE.23 (2006) (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) View page or View pdf Flavouring Group Evaluation 14, Revision 1 (FGE.14Rev1): Phenethyl alcohol, aldehyde, acetals, carboxylic acid and related esters from chemical group 15 and 22 [1] - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf Flavouring Group Evaluation 53, Revision 1 (FGE.53Rev1): Consideration of phenethyl alcohol, aldehyde, acid and related acetals and esters evaluated by JECFA (59th meeting) FGE.23Rev1 (2008) View page or View pdf EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):64577-91-9 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :62876 National Institute of Allergy and Infectious Diseases:Data 2-(1-butoxyethoxy)ethylbenzene Chemidplus:0064577919   References:   2-(1-butoxyethoxy)ethylbenzene NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 64577-91-9 Pubchem (cid): 62876 Pubchem (sid): 135019481   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): HMDB37820 FooDB: FDB016965 Export Tariff Code: 2911.00.5000 ChemSpider: View   Potential Blenders and core components note For Odor alliaceous dibutyl sulfide FL/FR dipropyl disulfide FL/FR camphoreous hinoki leaf oil FR caramellic 2-iso butyl-3-methyl pyrazine FL/FR chocolate 2,4,5- trimethyl thiazole FL/FR citrus methyl heptenone FL/FR neroli ketone FR petitgrain combava oil FR (E)-2- tetradecenal FL/FR coumarinic phthalide FL/FR dairy methyl butyl phenyl acetate FL/FR earthy 2- ethyl-3-methoxypyrazine FL/FR ethereal 2- methyl valeraldehyde FL/FR fatty (E)-2- octenal FL/FR floral allyl anthranilate FL/FR geranium pyran FR geranium specialty FR hyacinth fragrance FR hyacinth specialty FR (Z)- rose oxide FL/FR fruity (E)-2- hexen-1-ol FL/FR 2- hexen-1-ol FL/FR green acetaldehyde di-(Z)-3-hexen-1-yl acetal FL/FR acetaldehyde dipropyl acetal FL/FR acetaldehyde ethyl phenethyl acetal FL/FR birch leaf specialty FR bromstyrol CS iso butyl methyl ketone FL/FR 2-iso butyl thiazole FL/FR 2-iso butyl-3-methoxypyrazine FL/FR 2-sec- butyl-3-methoxypyrazine FL/FR cortex pyridine FL/FR 3,5,6-neo cyclocitral FR diphenyl oxide FL/FR flower hexene FR galbanum decatriene FL/FR galbanum oil terpeneless FL/FR galbanum oleoresin FL/FR galbanum resinoid FL/FR galbanum resinoid replacer FR geranium absolute FL/FR geranium thiazole FL/FR 1- heptanol FL/FR heptyl cinnamate FL/FR (Z)-2- hexen-1-ol FL/FR 3- hexen-1-ol FL/FR (Z)-3- hexen-1-yl (E)-crotonate FL/FR (E)-2- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl benzoate FL/FR (Z)-3- hexen-1-yl lactate FL/FR (Z)-3- hexen-1-yl methyl carbonate FL/FR (Z)-3- hexen-1-yl octanoate FL/FR (Z)-3- hexen-1-yl tiglate FL/FR 3- hexenal FL/FR hexoxyacetaldehyde dimethyl acetal FR hexyl heptanoate FL/FR lawsonia inermis leaf oil CO2 extract FR (Z)- leaf acetal FL/FR leafy acetal FL/FR leafy oxime FR methyl heptine carbonate FL/FR nerol oxide FL/FR (E,Z)-3,6- nonadien-1-ol FL/FR (Z,Z)-3,6- nonadien-1-ol FL/FR (E,Z)-2,6- nonadien-1-yl acetate FL/FR octanal dimethyl acetal FL/FR (Z)-5- octen-1-yl propionate FL/FR 1- penten-3-ol FL/FR green pepper oil FL/FR 3- phenyl propionaldehyde FL/FR iso propyl phenyl propionaldehyde FR rosa damascena leaf absolute FR rosacyanthin FR rose leaf absolute (rosa centifolia) FL/FR styralyl acetate FL/FR violet leaf oil (viola odorata) FL/FR herbal sweet basil absolute FL/FR 3- butylidene phthalide FL/FR herbal heptane FR lovage tincture FL/FR 2- pentyl acetate FL/FR rosemary oleoresin FL/FR leafy autumn fragrance FR curry leaf absolute FL/FR marine marine hexane FR minty iso pulegyl formate FL/FR musty cocoa butenal FL/FR nutty shoyu pyrazine FL/FR pine plectranthus glandulosus hook f. leaf oil cameroon FR sulfurous 3-( methyl thio) hexanol FL/FR woody alpha- farnesene FL/FR alpha- farnesene isomer FL/FR yeasty 2- octen-4-one FL/FR For Flavor No flavor group found for these acetaldehyde di-(Z)-3-hexen-1-yl acetal FL/FR allyl anthranilate FL/FR 2- ethyl-3-methoxypyrazine FL/FR green pea pyrazine FL heptyl cinnamate FL/FR 3- hexen-1-ol FL/FR (Z)-3- hexen-1-yl (E)-crotonate FL/FR 2- hexenal FL (E)-2- hexenal FL hexyl heptanoate FL/FR 2- methoxy-3-propyl pyrazine FL 2- methyl-3-heptanone FL 3- methyl-3-pentanol FL 1,5- octadien-3-ol FL 2- pentyl pyridine FL iso pulegyl formate FL/FR alliaceous alliaceous allyl thiopropionate FL dipropyl disulfide FL/FR aromatic leafy acetal FL/FR celery 3- butylidene phthalide FL/FR coumarinic phthalide FL/FR dairy methyl butyl phenyl acetate FL/FR 2- pentyl acetate FL/FR fatty (Z)-3- hexen-1-yl benzoate FL/FR (E)-2- octenal FL/FR fruity 2,4- hexadien-1-ol FL 2- hexen-1-ol FL/FR styralyl acetate FL/FR green acetaldehyde dipropyl acetal FL/FR acetaldehyde ethyl phenethyl acetal FL/FR iso butyl methyl ketone FL/FR 2-iso butyl pyridine FL 2-iso butyl thiazole FL/FR 2-iso butyl-3-methoxypyrazine FL/FR 2-iso butyl-3-methyl pyrazine FL/FR cocoa butenal FL/FR cortex pyridine FL/FR dibutyl sulfide FL/FR dihydroxyacetophenone (mixed isomers) FL diphenyl oxide FL/FR alpha- farnesene FL/FR alpha- farnesene isomer FL/FR galbanum decatriene FL/FR galbanum oil terpeneless FL/FR galbanum oleoresin FL/FR galbanum resinoid FL/FR geranium absolute FL/FR geranium thiazole FL/FR (Z)-2- hexen-1-ol FL/FR (E)-2- hexen-1-ol FL/FR (E)-2- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl lactate FL/FR (Z)-3- hexen-1-yl methyl carbonate FL/FR (Z)-3- hexen-1-yl octanoate FL/FR (Z)-3- hexen-1-yl tiglate FL/FR 3- hexenal FL/FR (E)-2- hexenal diethyl acetal FL 2- hexyl pyridine FL horseradish oil FL (Z)- leaf acetal FL/FR methyl heptenone FL/FR methyl heptine carbonate FL/FR 4- methyl thiazole FL nerol oxide FL/FR (E,Z)-3,6- nonadien-1-ol FL/FR (E,Z)-2,6- nonadien-1-yl acetate FL/FR octanal dimethyl acetal FL/FR (Z)-5- octen-1-yl propionate FL/FR 4- penten-1-yl acetate FL 1- penten-3-ol FL/FR green pepper distillates FL green pepper oil FL/FR 3- phenyl propionaldehyde FL/FR 2-(5-iso propyl-2-methyltetrahydro-2-thiophenyl)ethyl acetate FL rose leaf absolute (rosa centifolia) FL/FR (Z)- rose oxide FL/FR violet leaf oil (viola odorata) FL/FR herbal sweet basil absolute FL/FR curry leaf absolute FL/FR lovage tincture FL/FR rosemary oleoresin FL/FR metallic 3-( methyl thio) hexanol FL/FR musty shoyu pyrazine FL/FR nutty 2,4,5- trimethyl thiazole FL/FR radish horseradish flavor FL solvent 1- heptanol FL/FR sulfurous broccoli flavor FL vegetable 2-sec- butyl-3-methoxypyrazine FL/FR 2- methyl valeraldehyde FL/FR 2- octen-4-one FL/FR waxy (Z,Z)-3,6- nonadien-1-ol FL/FR (E)-2- tetradecenal FL/FR   Potential Uses: FR floral FR flower shop FR green FR green leaf FR herbal   Occurrence (nature, food, other):note   not found in nature   Synonyms:   acetaldehyde butyl phenyl ethyl acetal   acetaldehyde, butyl phenylethyl acetal   benzene, (2-(1-butoxyethoxy)ethyl)- 1- butoxy-1-(2-phenyl ethoxy) ethane 1- butoxy-1-(2-phenylethoxy)ethane 2- butoxy-2-phenyl ethoxyethane 2-(1- butoxyethoxy) ethyl benzene (2-(1- butoxyethoxy)ethyl) benzene (2-(1- butoxyethoxy)ethyl)benzene [2-(1- butoxyethoxy)ethyl]benzene 2-(1- butoxyethoxy)ethylbenzene   Articles:   None found yet. Try the PubMed Search.

Notes: Flavour ingredient with a green pepper taste; useful in vegetable as fruit flavours