(S)-(+)-lilyall
benzenepropanal, 4-(1,1-dimethylethyl)-a-methyl-, (aS)-

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Name: (2S)-3-(4-tert-butylphenyl)-2-methylpropanal CAS Number: 75166-30-2 3D/inchi FDA UNII: WP1PPC4R9G Nikkaji Web: J3.054.748I XlogP3-AA: 3.90 (est) Molecular Weight: 204.31260000 Formula: C14 H20 O NMR Predictor: Predict (works with chrome, Edge or firefox) 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 Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 277.70 °C. @ 760.00 mm Hg (est) Flash Point: 250.00 °F. TCC ( 120.90 °C. ) (est) logP (o/w): 4.070 (est) Soluble in:   alcohol   water, 7.859 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: floral lily of the valley Odor Description:at 100.00 %. lily of the valley Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers:   None found   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: 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 (S)-(+)-lilyall flavor usage levels up to:   not for flavor use.   Safety References: 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 :1715213 National Institute of Allergy and Infectious Diseases:Data WGK Germany:3 (2S)-3-(4-tert-butylphenyl)-2-methylpropanal Chemidplus:0075166302   References: Leffingwell: Chirality or Article   (2S)-3-(4-tert-butylphenyl)-2-methylpropanal NIST Chemistry WebBook: Search Inchi Pubchem (cid): 1715213 Pubchem (sid): 163640802   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 ChemSpider: View Wikipedia: View   Potential Blenders and core components note For Odor aldehydic adoxal (Givaudan) FL/FR citronellyl oxyacetaldehyde FL/FR lily pentanal FR animal para- cresyl isobutyrate FL/FR balsamic linalyl cinnamate FL/FR citrus benzyl anthranilate FR citrus ocimenol FR methyl indole-1-carboxylate FR tetrahydromyrcenol FR floral alpha- amyl cinnamaldehyde dimethyl acetal FL/FR alpha- butyl cinnamaldehyde FL/FR 4-iso butyl cyclohexane propanal FR citronellyl (R)-lactate FR citronellyl ethoxalate FR corps popinal FR cumin carbinol FR cyclamen aldehyde / methyl anthranilate schiff's base FR cyclamen homoaldehyde FR cyclohexyl ethyl alcohol FL/FR 2,5- dimethyl-2-indan methanol FR 4- ethyl cyclohexane propanal FR (E,E)- farnesol FL/FR floral butanal FR floral specialty FR freesia acetate FR ginger lily fragrance FR (Z)-4- hepten-2-yl salicylate FR (Z)-3- hexen-1-yl salicylate FL/FR hydrangea fragrance 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 leerall / methyl anthranilate schiff's base FR lily flower absolute FR lily fragrance FR water lily fragrance FR calla lily fragrance FR lily of the valley absolute FR lily of the valley fragrance FR lily of the valley specialty FR lily propanol FR lilyall FR (R)-(-)- lilyall FR lilyall / methyl anthranilate schiff's base FR linalyl benzoate FL/FR linalyl phenyl acetate FL/FR magnolia cyclohexanol FR magnolia decadienal FR methoxycitronellal FR 4- methyl cyclohexane propanal FR 2- methyl octanal FL/FR 1- methyl-3-(2-methyl propyl) cyclohexanol FR 4-(4- methyl-4-hydroxyamyl)-delta3-cyclohexenecarboxaldehyde FR 3- methyl-6-ethyl-5-octen-1-ol FR muguet butanal FR muguet butanol FR muguet carbaldehyde FR muguet carbinol FL/FR muguet ethanol FR muguet nitrile FR muguet octadienol FR muguet propanol FR muguet specialty FR octahydro-4,7-methano-1H-indene-5-acetaldehyde FR 4- propyl cyclohexane propanal FR alpha- terpinyl anthranilate FL/FR tetrahydrolinalool FL/FR ylang ylang flower oil FL/FR ylang ylang flower oil CO2 extract FL/FR ylang ylang flower oil fractions FR ylang ylang flower oil I FL/FR ylang ylang flower oil II FL/FR ylang ylang oil III fractions FR ylang ylang oil replacer FR green phenyl acetaldehyde diethyl acetal FL/FR violet decenol FR herbal dimethyl benzyl carbinyl formate FL/FR marine ozone propanal FR woody amber dioxane FR hydroxycitronellal diisotridecyl acetal FR For Flavor No flavor group found for these alpha- amyl cinnamaldehyde dimethyl acetal FL/FR dimethyl benzyl carbinyl formate FL/FR (E,E)- farnesol FL/FR hydroxycitronellal propylene glycol acetal FL/FR linalyl phenyl acetate FL/FR 2- methyl octanal FL/FR phenyl acetaldehyde diethyl acetal FL/FR alpha- terpinyl anthranilate FL/FR alpha- butyl cinnamaldehyde FL/FR aromatic aromatic para- cresyl isobutyrate FL/FR citrus citronellyl oxyacetaldehyde FL/FR floral muguet carbinol FL/FR tetrahydrolinalool FL/FR ylang ylang flower oil FL/FR ylang ylang flower oil CO2 extract FL/FR ylang ylang flower oil I FL/FR ylang ylang flower oil II FL/FR fruity linalyl benzoate FL/FR linalyl cinnamate FL/FR green cyclohexyl ethyl alcohol FL/FR (Z)-3- hexen-1-yl salicylate FL/FR melon hydroxycitronellal diethyl acetal FL/FR powdery hydroxycitronellol FL/FR waxy adoxal (Givaudan) FL/FR hydroxycitronellal FL/FR hydroxycitronellal dimethyl acetal FL/FR   Potential Uses: None Found   Occurrence (nature, food, other):note   not found in nature   Synonyms:   benzenepropanal, 4-(1,1-dimethylethyl)-a-methyl-, (aS)-   butylphenyl methylpropional, (+)- (2S)-3-(4-tert- butylphenyl)-2-methylpropanal (S)-(+)- lilial (2S)-2- methyl-3-[4-(2-methyl-2-propanyl)phenyl]propanal   Articles:   None found yet. Try the PubMed Search.

Notes: None found

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