2-methyl octanal
2-methyloctanal

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  BOC Sciences

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  Product(s):
  7786-29-0 2-Methyloctanal

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  Penta International Corporation

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  Product(s):
  13-51300 METHYL HEXYL ACETALDEHYDE

Name: 2-methyloctanal CAS Number: 7786-29-0 3D/inchi Other(deleted CASRN): 72598-55-1 ECHA EINECS - REACH Pre-Reg: 232-093-0 FDA UNII: L193398KLN Nikkaji Web: J65.643G MDL: MFCD00216765 CoE Number: 113 XlogP3-AA: 3.30 (est) Molecular Weight: 142.24166000 Formula: C9 H18 O NMR Predictor: Predict (works with chrome, Edge or firefox) 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: 270 2-methyloctanal DG SANTE Food Flavourings: 05.024 2-methyloctanal FEMA Number: 2727 2-methyloctanal FDA: No longer provide for the use of these seven synthetic flavoring substances FDA Mainterm (SATF): 7786-29-0 ; 2-METHYLOCTANAL FDA Regulation: FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION Subpart F--Flavoring Agents and Related Substances Sec. 172.515 Synthetic flavoring substances and adjuvants.   Physical Properties: Appearance: colorless clear oily liquid (est) Assay: 90.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.82200 to 0.83000 @ 20.00 °C. Pounds per Gallon - est.: 6.848 to 6.914 Refractive Index: 1.42300 @ 14.00 °C. Boiling Point: 82.00 to 83.00 °C. @ 20.00 mm Hg Acid Value: 10.00 max. KOH/g Vapor Pressure: 0.759000 mmHg @ 25.00 °C. (est) Flash Point: 156.00 °F. TCC ( 68.89 °C. ) logP (o/w): 3.305 (est) Soluble in:   alcohol   dipropylene glycol   water, 152.1 mg/L @ 25 °C (est) Insoluble in:   water Stability:   bath foam   hair spray   non-discoloring in most media   soap   Organoleptic Properties: Odor Type: floral floral rose lily muguet Odor Description:at 100.00 %. floral rose lily muguet Odor and/or flavor descriptions from others (if found).   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers: BOC Sciences For experimental / research use only. 2-Methyloctanal Nagar Haveli Perfumes & Aromatics 2-Methyl Octanal Odor: Floral rose lily Parchem 2-methyl octanal Penta International METHYL HEXYL ACETALDEHYDE   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. Human Experience: 10 % solution: no irritation or sensitization. Oral/Parenteral Toxicity: oral-rat LD50 > 5000 mg/kg Food and Chemical Toxicology. Vol. 20, Pg. 753, 1982. Dermal Toxicity: skin-rabbit LD50 > 5000 mg/kg Food and Chemical Toxicology. Vol. 20, Pg. 753, 1982. 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 2-methyl octanal usage levels up to:   1.0000 % in the fragrance concentrate.   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: 3 Click here to view publication 3   average usual ppm average maximum ppm baked goods: - 2.00000 beverages(nonalcoholic): - 1.00000 beverages(alcoholic): - - breakfast cereal: - - cheese: - - chewing gum: - - condiments / relishes: - - confectionery froastings: - - egg products: - - fats / oils: - - fish products: - - frozen dairy: - 1.00000 fruit ices: - 1.00000 gelatins / puddings: - - granulated sugar: - - gravies: - - hard candy: - 2.00000 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: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):7786-29-0 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :24583 National Institute of Allergy and Infectious Diseases:Data WGK Germany:2 2-methyloctanal Chemidplus:0007786290   References:   2-methyloctanal NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 7786-29-0 Pubchem (cid): 24583 Pubchem (sid): 134991370   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): HMDB31684 FooDB: FDB008345 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor aldehydic citronellyl oxyacetaldehyde FL/FR 6,7,8- decen-1-ol FR lily pentanal FR muguet undecadienal FR nonanal (aldehyde C-9) FL/FR nonanal diethyl acetal FL/FR animal para- cresyl phenyl acetate FL/FR balsamic callitropsis araucarioides wood oil FR linalyl cinnamate FL/FR chocolate iso amyl phenyl acetate FL/FR citrus abronia fragrance FR benzyl anthranilate FR citronella fragrance FR citronitrile (Symrise) FR citrus ocimenol FR (Z)-4- decenal FL/FR myrmac aldehyde FR tetrahydromyrcenol FR floral alpha- amyl cinnamaldehyde dimethyl acetal FL/FR iso amyl undecylenate FL/FR benzyl alcohol FL/FR butyl benzyl ether FL/FR alpha- butyl cinnamaldehyde FL/FR citronellal FL/FR laevo- citronellol FL/FR citronellyl anthranilate FL/FR citronellyl ethoxalate FR citronellyl propionate FL/FR para- cresyl propionaldehyde CS cumin carbinol FR cyclamen aldehyde / methyl anthranilate schiff's base FR cyclamen homoaldehyde FR cyclohexyl ethyl alcohol FL/FR cyclohexyl propanol FR damascate FR gamma- damascone FR (Z)-alpha- damascone FL/FR 2- decalinol FR (Z)-4- decen-1-yl acetate FL/FR dihydrocarvyl acetate FL/FR ethyl linalyl acetal FR ethyl phenoxyacetate FR (E,E)- farnesol FL/FR farnesyl acetate FL/FR floral butanal FR floral pyran FR floral pyranol FR floral specialty FR freesia acetate FR gardenia decalone FR geranium oil egypt FL/FR geranium oil egypt fractions FR geranium oil terpeneless FL/FR geranium petiole oil india FL/FR geranium rose oil FL/FR geranium rose-scented oil cuba FR geranyl acetate FL/FR (E)- geranyl linalool FL/FR glycoacetal FR hawthorn ethanol FR (Z)-4- hepten-2-yl salicylate FR hydroxycitronellal FL/FR hydroxycitronellal / methyl anthranilate schiff's base FR hydroxycitronellal diethyl acetal FL/FR hydroxycitronellal dimethyl acetal FL/FR hydroxycitronellal distillation residue distillates FR hydroxycitronellal nitrile FR hydroxycitronellal propylene glycol acetal FL/FR hydroxycitronellal residue FR hydroxycitronellol FL/FR jasimia FR leerall FR leerall / methyl anthranilate schiff's base FR calla lily fragrance FR lily of the valley specialty FR lily propanol FR lilyall FR lilyall / methyl anthranilate schiff's base FR linalyl benzoate FL/FR linalyl propionate FL/FR linden blossom fragrance FR linden blossom specialty FR magnolia cyclohexanol FR magnolia decadienal FR methoxycitronellal FR 1- methyl-3-(2-methyl propyl) cyclohexanol FR 3- methyl-6-ethyl-5-octen-1-ol FR muguet butanal FR muguet butanol FR muguet carbaldehyde FR muguet carbinol FL/FR muguet carboxaldehyde FR muguet ethanol FR muguet nitrile FR muguet octadienol FR muguet propanol FR muguet shiseol FL/FR muguet specialty FR musk acetate FR neryl acetate FL/FR neryl isovalerate FL/FR nonanol FL/FR octahydro-4,7-methano-1H-indene-5-acetaldehyde FR octyl isovalerate FL/FR peony alcohol FR phenethyl acetate FL/FR phenethyl alcohol FL/FR phenethyl anthranilate FL/FR phenethyl heptanoate FL/FR phenethyl lactate FL/FR phenethyl phenyl acetate FL/FR phenethyl salicylate FL/FR phenyl acetaldehyde digeranyl acetal FR phenyl glycol diacetate FR primrose fragrance FR rhodinol substitues FL/FR rhodinyl acetate substitutes FL/FR rhodinyl benzoate FR rosa alba flower oil CO2 extract FR rose absolute (rosa centifolia) FL/FR rose absolute (rosa centifolia) morocco FL/FR rose absolute (rosa damascena) bulgaria FL/FR rose absolute (rosa damascena) turkey FL/FR rose absolute pentanol FR rose acetate FR rose blossom pentanol FR rose butanoate FL/FR rose concrete (rosa centifolia) FR rose concrete (rosa damascena) FR rose oil (rosa centifolia) egypt FL/FR rose oil (rosa damascena) bulgaria FL/FR rose oil (rosa damascena) iran FL/FR rose oil (rosa damascena) turkey FL/FR rose oil replacer FR laevo- rose oxide FL/FR rose pyran FR rose specialty FR styralyl propionate FL/FR alpha- terpinyl anthranilate FL/FR tetrahydrolinalool FL/FR 2- undecen-1-ol FL/FR (E)-2- undecen-1-ol FL/FR ylang ylang flower oil FL/FR ylang ylang flower oil CO2 extract FL/FR fruity (E)-alpha- damascone FL/FR ethyl para-methyl-beta-phenyl glycidate FR plum crotonate FR strawberry glycidate 2 FL/FR green iso decanal FL/FR 2- heptyl tetrahydrofuran FR [(4E,4Z)-5- methoxy-3-methyl-4-penten-1-yl] benzene FR phenyl acetaldehyde FL/FR phenyl acetaldehyde diethyl acetal FL/FR phenyl acetaldehyde dimethyl acetal FL/FR phenyl hexyl acetate FR herbal chamomile valerate FR dimethyl benzyl carbinyl formate FL/FR laevo- menthyl propionate FL/FR rose oil (rosa centifolia) morocco FL/FR honey phenyl acetic acid FL/FR marine ozone propanal FR powdery para- anisyl alcohol FL/FR spicy maja fragrance FR pepper hexanone FR woody hydroxycitronellal diisotridecyl acetal FR For Flavor No flavor group found for these alpha- amyl cinnamaldehyde dimethyl acetal FL/FR iso amyl undecylenate FL/FR butyl benzyl ether FL/FR (Z)-alpha- damascone FL/FR iso decanal FL/FR (Z)-4- decen-1-yl acetate FL/FR dimethyl benzyl carbinyl formate FL/FR (E,E)- farnesol FL/FR (E)- geranyl linalool FL/FR 3- heptyl acetate FL hydroxycitronellal propylene glycol acetal FL/FR laevo- menthyl propionate FL/FR nonanal diethyl acetal FL/FR octyl isovalerate FL/FR phenethyl heptanoate FL/FR phenethyl lactate FL/FR phenyl acetaldehyde diethyl acetal FL/FR rhodinyl acetate substitutes FL/FR alpha- terpinyl anthranilate FL/FR (E)-2- undecen-1-ol FL/FR 2- undecen-1-ol FL/FR alpha- butyl cinnamaldehyde FL/FR aldehydic aldehydic nonanal (aldehyde C-9) FL/FR berry rhodinol substitues FL/FR citrus citronellyl oxyacetaldehyde FL/FR (Z)-4- decenal FL/FR styralyl propionate FL/FR floral iso amyl phenyl acetate FL/FR citronellal FL/FR laevo- citronellol FL/FR citronellyl propionate FL/FR dihydrocarvyl acetate FL/FR farnesyl acetate FL/FR geranium oil egypt FL/FR geranium oil terpeneless FL/FR geranium petiole oil india FL/FR geranium rose oil FL/FR muguet carbinol FL/FR muguet shiseol FL/FR neryl acetate FL/FR phenethyl alcohol FL/FR phenethyl anthranilate FL/FR phenyl acetic acid FL/FR rose absolute (rosa centifolia) FL/FR rose absolute (rosa centifolia) morocco FL/FR rose absolute (rosa damascena) bulgaria FL/FR rose absolute (rosa damascena) turkey FL/FR rose oil (rosa centifolia) egypt FL/FR rose oil (rosa damascena) bulgaria FL/FR rose oil (rosa damascena) iran FL/FR rose oil (rosa damascena) turkey FL/FR laevo- rose oxide FL/FR tetrahydrolinalool FL/FR ylang ylang flower oil FL/FR ylang ylang flower oil CO2 extract FL/FR fruity para- anisyl alcohol FL/FR benzyl alcohol FL/FR citronellyl anthranilate FL/FR (E)-alpha- damascone FL/FR linalyl benzoate FL/FR linalyl cinnamate FL/FR neryl isovalerate FL/FR rose butanoate FL/FR strawberry glycidate 2 FL/FR green cyclohexyl ethyl alcohol FL/FR geranyl acetate FL/FR phenyl acetaldehyde dimethyl acetal FL/FR herbal linalyl propionate FL/FR rose oil (rosa centifolia) morocco FL/FR honey phenethyl acetate FL/FR phenethyl phenyl acetate FL/FR phenyl acetaldehyde FL/FR medicinal, phenethyl salicylate FL/FR melon hydroxycitronellal diethyl acetal FL/FR phenolic para- cresyl phenyl acetate FL/FR powdery hydroxycitronellol FL/FR waxy hydroxycitronellal FL/FR hydroxycitronellal dimethyl acetal FL/FR nonanol FL/FR   Potential Uses: FR aldehydic FR clover   diffusion FR grapefruit FR lily FR melon   Occurrence (nature, food, other):note   teucrium polium Search Trop Picture   Synonyms:   methyl hexyl acetaldehyde 2- methyl octanal alpha- methyl octanal 2- methyl octanaldehyde   methylhexylacetaldehyde 2- methyloctanal a- methyloctanal   octanal, 2-methyl-   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Notes: Used as a food additive [EAFUS]