vanillin hexylene glycol acetal
phenol, 2-methoxy-4-(4,4,6-trimethyl-1,3-dioxan-2-yl)-

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CAS Number: 52514-66-6 3D/inchi % from: 70.00% to 75.00% ECHA EINECS - REACH Pre-Reg: 257-986-2 FDA UNII: Search Nikkaji Web: J86.592C XlogP3-AA: 2.40 (est) Molecular Weight: 252.31020000 Formula: C14 H20 O4 NMR Predictor: Predict (works with chrome, Edge or firefox) Also(can) Contains: hexylene glycol 22.00% to 27.00%   vanillin 2.00% to 5.00% Category: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   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 70.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 358.00 to 359.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.000012 mmHg @ 25.00 °C. (est) Flash Point: 222.00 °F. TCC ( 105.56 °C. ) logP (o/w): 2.523 (est) Shelf Life: 48.00 month(s) or longer if stored properly. Storage: store in cool, dry place in tightly sealed containers, protected from heat and light. store under nitrogen. Storage: store under nitrogen. Soluble in:   alcohol   water, slightly   water, 185.1 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: vanilla sweet creamy vanilla smoky Odor Description:at 100.00 %. sweet creamy vanilla smoky Odor and/or flavor descriptions from others (if found). Bedoukian Research VANILLIN HEXYLENE GLYCOL ACETAL ≥70.0% (sum of isomers) Odor Description:Sweet, creamy, rich vanilla odor with slightly smoky undertone For use in vanilla, chocolate, and other fragrances and accords for richness and intense vanilla note; particularly useful in candle and body care fragrances.   Cosmetic Information: None found   Suppliers:   None found   Safety Information: European information : Most important hazard(s): Xi - Irritant R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. 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 36 - Wear suitable protective clothing.   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: 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 vanillin hexylene glycol acetal usage levels up to:   5.0000 % in the fragrance concentrate.   Recommendation for vanillin hexylene glycol acetal flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):52514-66-6 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :103654 National Institute of Allergy and Infectious Diseases:Data WGK Germany:1 2-methoxy-4-(4,4,6-trimethyl-1,3-dioxan-2-yl)phenol Chemidplus:0052514666   References:   2-methoxy-4-(4,4,6-trimethyl-1,3-dioxan-2-yl)phenol NIST Chemistry WebBook: Search Inchi Pubchem (cid): 103654 Pubchem (sid): 135061003   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 HMDB (The Human Metabolome Database): Search Export Tariff Code: 2911.00.5000 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these bird of paradise fragrance FR acidic acidic cyclohexyl acetic acid FL/FR aldehydic acetyl nonyryl FL/FR amber ambrette seed oil FL/FR anisic ortho- acetanisole FL/FR para- acetanisole FL/FR ortho- anisaldehyde FL/FR para- anisaldehyde FL/FR methyl para-anisate FL/FR balsamic benzoin FL/FR sumatra benzoin absolute FL/FR siam benzoin absolute FL/FR benzoin absolute replacer FL/FR sumatra benzoin gum FL/FR sumatra benzoin resin FL/FR siam benzoin resin FL/FR benzoin resin replacer FR sumatra benzoin resinoid FL/FR siam benzoin resinoid FL/FR benzophenone FR 1- benzoyl acetone FL/FR iso butyl benzoate FL/FR cinnamyl alcohol FL/FR ethyl cinnamate FL/FR peru balsam absolute FL/FR peru balsam oil FL/FR peru balsam resinoid FL/FR berry raspberry ketone methyl ether FL/FR buttery acetoin FL/FR acetyl butyryl FL/FR acetyl isobutyryl FL/FR acetyl propionyl FL/FR butyl butyryl lactate FL/FR caramellic 2-oxo butyric acid FL/FR levulinic acid FL/FR strawberry furanone acetate FL/FR cheesy butyric acid FL/FR chocolate chocolate specialty FR cocoa oleoresin FL/FR cocoa pentenal FL/FR vanillyl ethyl ether FL/FR coconut alpha- angelica lactone FL/FR coconut decanone methyl FR delta- decalactone FL/FR delta-2- dodecenolactone FL/FR delta- nonalactone FL/FR gamma- octalactone FL/FR delta- undecalactone FL/FR coumarinic coumane FL/FR phthalide FL/FR creamy gamma- butyrolactone FL/FR creamy lactone FL/FR geranyl ethyl acetal FR 3- heptyl dihydro-5-methyl-2(3H)-furanone FL/FR para- vanillic acid FL/FR para- vanillyl alcohol FL/FR veratraldehyde FL/FR earthy 1- nonen-3-ol FL/FR fatty (Z)- dairy lactone FL/FR ethyl undecylenate FL/FR 4- methyl octanoic acid FL/FR fermented butyl laevo-lactate FL/FR floral acetophenone FL/FR para- anisaldehyde / methyl anthranilate schiff's base FR anisyl propanal / methyl anthranilate schiff's base FR coffee flower absolute FR para- cresyl laurate FL/FR dimethyl alpha-ionone FR dimethyl anthranilate FL/FR geranyl phenyl acetate FL/FR heliotropin FL/FR (E)-beta- ionone FL/FR alpha- irone FL/FR ortho- methyl acetophenone FL/FR para- methyl acetophenone FL/FR beta-iso methyl ionone FL/FR alpha-iso methyl ionone (50% min.) FL/FR alpha-iso methyl ionone (90% min.) FL/FR methyl ionyl acetate FL/FR orris rhizome resinoid (iris pallida) FL/FR iso propyl phenyl acetate FL/FR rhodinol FL/FR rhodinyl phenyl acetate FL/FR (E)-2,5,9- trimethyl-4,9-decadien-1-al FR fruity acetoin acetate FL/FR acetyl methyl anthranilate FL/FR para- anisyl propionate FL/FR cherry oxyacetate FL/FR gamma- decalactone FL/FR ethyl methyl-para-tolyl glycidate FL/FR farnesyl acetone FL/FR guaiacyl propionate FL/FR methyl (Z)-5-octenoate FL/FR octyl butyrate FL/FR peach pivalate FR tolualdehydes (mixed o,m,p) FL/FR gamma- undecalactone (aldehyde C-14 (so-called)) FL/FR vanilla carboxylate FL/FR green iso butyl benzyl carbinol FL/FR butyl lactate FL/FR (Z)-4- hepten-1-ol FL/FR (Z)-4- heptenal FL/FR (Z)-4- heptenal diethyl acetal FL/FR para- methyl hydratropaldehyde FL/FR phenoxyethyl isobutyrate FL/FR minty menthoxypropane diol FL/FR vanillin menthoxypropane diol acetal FL/FR mushroom 3- octen-2-ol FL/FR musk cyclohexadecanone FR ethylene brassylate FL/FR exaltone (Firmenich) FR dextro,laevo- muscone FL/FR musk amberol FR musk indane FR musk tetralin FL/FR omega- pentadecalactone FL/FR musty cocoa butenal FL/FR tetrahydrogeranyl acetone FL/FR naphthyl 2,4- dimethyl benzaldehyde FL/FR para- methyl anisole FL/FR beta- naphthyl ethyl ether FL/FR nutty nutty cyclohexenone FL/FR resorcinol FR 2,3,5,6- tetramethyl pyrazine FL/FR 2,3,5- trimethyl pyrazine FL/FR phenolic ethyl vanillate FL/FR ortho- guaiacol FL/FR powdery para- anisyl acetate FL/FR para- anisyl alcohol FL/FR alpha- methyl ionone FL/FR smoky alpha- ethoxy-ortho-cresol FL/FR spicy para- anisyl formate FL/FR dianthus ethone FR 4- ethyl guaiacol FL/FR (E)-para- methoxycinnamaldehyde FL/FR para- methoxycinnamaldehyde FL/FR 4- methyl guaiacol FL/FR spicy acetoacetate FL/FR zingerone FL/FR sweet tonka bean absolute replacer FR vanilla bean absolute (vanilla spp.) FL/FR vanilla oleoresin bali FL/FR vanilla resinoid FL/FR vanilla tahitensis fruit extract FL/FR tobacco methyl benzoxole FL/FR tonka 6- amyl-alpha-pyrone FL/FR coumarin FR mint lactone FL/FR octahydrocoumarin FL/FR tropical curcuma amada roxb. rhizome oil CO2 extract FL/FR vanilla acetovanillone FL/FR crème brulee fragrance FR ortho- dimethyl hydroquinone FL/FR ethyl vanillin FL/FR ethyl vanillin acetate FR ethyl vanillin diethyl acetal FR ethyl vanillin hexylene glycol acetal FR ethyl vanillin isobutyrate FL/FR ethyl vanillin propylene glycol acetal FL/FR heliotropyl alcohol FL/FR methyl vanillate FL/FR propenyl guaethol FL/FR vanilla FR vanilla aromatica fruit extract FL/FR vanilla bean absolute (vanilla planifolia) FL/FR vanilla bean absolute CO2 extract (vanilla planifolia) FL/FR vanilla bean fragrance FR vanilla bean oil (vanilla planifolia) FR vanilla bean oil (vanilla tahitensis) FL/FR vanilla bean oil CO2 extract FL/FR vanilla bean tincture FR vanilla cresol FR vanilla extract FL/FR french vanilla fragrance FR vanilla fragrance FR country vanilla fragrance FR vanilla oleoresin bourbon FL/FR vanilla planifolia fruit extract FL/FR vanilla planifolia fruit infusion FR vanilla planifolia fruit water FL/FR vanilla specialty FR vanilla tahitensis fruit absolute FR vanilla tahitensis fruit absolute CO2 extract FL/FR vanilla tahitensis fruit oil CO2 extract FR vanillin FL/FR vanillin 2,3-butylene glycol acetal FL/FR vanillin propylene glycol acetal FL/FR vanillyl acetate FL/FR vanillyl butyl ether FL/FR vanillyl isobutyrate FL/FR vanillylidene acetone FL/FR vegetable methional FL/FR waxy allyl nonanoate FL/FR ethyl palmitate FL/FR methyl laurate FL/FR 2- nonanol FL/FR octyl isobutyrate FL/FR delta- tetradecalactone FL/FR undecanoic acid FL/FR woody amber formate FR guaiacwood oil FL/FR guaiacyl acetate FL/FR 4- hydroxybenzaldehyde FL/FR (+)-alpha- santalyl acetate FL/FR timber propanol FR vetiveryl acetate FL/FR woody epoxide FR For Flavor No flavor group found for these para- anisyl propionate FL/FR benzoin FL/FR 1- benzoyl acetone FL/FR coumane FL/FR ortho- dimethyl hydroquinone FL/FR delta-2- dodecenolactone FL/FR alpha- ethoxy-ortho-cresol FL/FR farnesyl acetone FL/FR guaiacyl propionate FL/FR heliotropyl alcohol FL/FR (E)-para- methoxycinnamaldehyde FL/FR beta-iso methyl ionone FL/FR methyl para-anisate FL/FR methyl vanillate FL/FR (+)-alpha- santalyl acetate FL/FR vanillin menthoxypropane diol acetal FL/FR vanillyl butyl ether FL/FR vetiveryl acetate FL/FR acidic acidic levulinic acid FL/FR aldehydic acetyl nonyryl FL/FR amber ambrette seed oil FL/FR iso butyl benzyl carbinol FL/FR musk tetralin FL/FR anisic para- acetanisole FL/FR ortho- anisaldehyde FL/FR ortho- methyl acetophenone FL/FR balsamic benzoin absolute replacer FL/FR sumatra benzoin gum FL/FR siam benzoin resin FL/FR sumatra benzoin resin FL/FR siam benzoin resinoid FL/FR sumatra benzoin resinoid FL/FR ethyl cinnamate FL/FR peru balsam absolute FL/FR peru balsam oil FL/FR peru balsam resinoid FL/FR vanillylidene acetone FL/FR berry raspberry ketone methyl ether FL/FR brown 2-oxo butyric acid FL/FR buttery butyl laevo-lactate FL/FR caramellic strawberry furanone acetate FL/FR cherry heliotropin FL/FR para- methoxycinnamaldehyde FL/FR chocolate cocoa oleoresin FL/FR citrus tetrahydrogeranyl acetone FL/FR coconut delta- decalactone FL/FR octahydrocoumarin FL/FR cooling menthoxypropane diol FL/FR coumarinic phthalide FL/FR creamy acetoin FL/FR acetyl butyryl FL/FR acetyl isobutyryl FL/FR 6- amyl-alpha-pyrone FL/FR alpha- angelica lactone FL/FR para- anisaldehyde FL/FR butyl butyryl lactate FL/FR creamy lactone FL/FR ethyl vanillate FL/FR 4- hydroxybenzaldehyde FL/FR para- methyl acetophenone FL/FR mint lactone FL/FR delta- nonalactone FL/FR octyl isobutyrate FL/FR delta- undecalactone FL/FR gamma- undecalactone (aldehyde C-14 (so-called)) FL/FR para- vanillic acid FL/FR para- vanillyl alcohol FL/FR veratraldehyde FL/FR dairy methyl (Z)-5-octenoate FL/FR earthy 1- nonen-3-ol FL/FR fatty (Z)- dairy lactone FL/FR ethyl undecylenate FL/FR 4- methyl octanoic acid FL/FR floral cocoa pentenal FL/FR geranyl phenyl acetate FL/FR alpha-iso methyl ionone (50% min.) FL/FR alpha-iso methyl ionone (90% min.) FL/FR orris rhizome resinoid (iris pallida) FL/FR rhodinol FL/FR fruity acetoin acetate FL/FR acetyl methyl anthranilate FL/FR para- anisyl acetate FL/FR para- anisyl alcohol FL/FR iso butyl benzoate FL/FR cherry oxyacetate FL/FR gamma- decalactone FL/FR dimethyl anthranilate FL/FR ethyl methyl-para-tolyl glycidate FL/FR 3- heptyl dihydro-5-methyl-2(3H)-furanone FL/FR alpha- methyl ionone FL/FR tolualdehydes (mixed o,m,p) FL/FR vanilla carboxylate FL/FR green butyl lactate FL/FR cinnamyl alcohol FL/FR cocoa butenal FL/FR (Z)-4- hepten-1-ol FL/FR (Z)-4- heptenal FL/FR (Z)-4- heptenal diethyl acetal FL/FR para- methyl hydratropaldehyde FL/FR phenoxyethyl isobutyrate FL/FR honey iso propyl phenyl acetate FL/FR lactonic gamma- octalactone FL/FR milky gamma- butyrolactone FL/FR mushroom 3- octen-2-ol FL/FR musk ethylene brassylate FL/FR dextro,laevo- muscone FL/FR musty 2,3,5- trimethyl pyrazine FL/FR naphthyl 2,4- dimethyl benzaldehyde FL/FR para- methyl anisole FL/FR nutty methyl benzoxole FL/FR nutty cyclohexenone FL/FR 2,3,5,6- tetramethyl pyrazine FL/FR powdery ortho- acetanisole FL/FR acetophenone FL/FR beta- naphthyl ethyl ether FL/FR rummy vanillyl ethyl ether FL/FR sour butyric acid FL/FR spicy para- anisyl formate FL/FR siam benzoin absolute FL/FR sumatra benzoin absolute FL/FR 4- methyl guaiacol FL/FR spicy acetoacetate FL/FR zingerone FL/FR sweet cyclohexyl acetic acid FL/FR vanilla bean absolute (vanilla spp.) FL/FR vanilla oleoresin bali FL/FR vanilla resinoid FL/FR vanilla tahitensis fruit extract FL/FR toasted acetyl propionyl FL/FR tomato methional FL/FR tropical curcuma amada roxb. rhizome oil CO2 extract FL/FR vanilla acetovanillone FL/FR ethyl vanillin FL/FR ethyl vanillin isobutyrate FL/FR ethyl vanillin propylene glycol acetal FL/FR omega- pentadecalactone FL/FR propenyl guaethol FL/FR vanilla aromatica fruit extract FL/FR vanilla bean absolute (vanilla planifolia) FL/FR vanilla bean absolute CO2 extract (vanilla planifolia) FL/FR vanilla bean oil (vanilla tahitensis) FL/FR vanilla bean oil CO2 extract FL/FR vanilla extract FL/FR vanilla oleoresin bourbon FL/FR vanilla planifolia fruit extract FL/FR vanilla planifolia fruit water FL/FR vanilla tahitensis fruit absolute CO2 extract FL/FR vanillin FL/FR vanillin 2,3-butylene glycol acetal FL/FR vanillin propylene glycol acetal FL/FR vanillyl acetate FL/FR vanillyl isobutyrate FL/FR waxy allyl nonanoate FL/FR para- cresyl laurate FL/FR ethyl palmitate FL/FR methyl laurate FL/FR 2- nonanol FL/FR octyl butyrate FL/FR rhodinyl phenyl acetate FL/FR delta- tetradecalactone FL/FR undecanoic acid FL/FR woody 4- ethyl guaiacol FL/FR ortho- guaiacol FL/FR guaiacwood oil FL/FR guaiacyl acetate FL/FR (E)-beta- ionone FL/FR alpha- irone FL/FR methyl ionyl acetate FL/FR   Potential Uses: FR vanilla   Occurrence (nature, food, other):note   not found in nature   Synonyms: 2-(3'- methoxy-4'-hydroxyphenyl)-4,4,6-trimethyl-1,3-dioxane 2- methoxy-4-(4,4,6-trimethyl-1,3-dioxan-2-yl)phenol   phenol, 2-methoxy-4-(4,4,6-trimethyl-1,3-dioxan-2-yl)-   Articles:   None found yet. 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Notes: None found

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