(E)-citrus nitrile
(E)-3-methyl-5-phenyl-2-pentene nitrile

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Name: (E)-3-methyl-5-phenylpent-2-enenitrile CAS Number: 53243-60-0 3D/inchi ECHA EINECS - REACH Pre-Reg: 258-447-4 FDA UNII: Search Nikkaji Web: J295.915A XlogP3-AA: 3.30 (est) Molecular Weight: 171.24261000 Formula: C12 H13 N 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 Perfumer and Flavorist: Search Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Appearance: pale yellow clear liquid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Boiling Point: 308.00 to 310.00 °C. @ 760.00 mm Hg (est) Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est) Flash Point: 287.00 °F. TCC ( 141.80 °C. ) (est) logP (o/w): 3.345 (est) Soluble in:   alcohol   water, 43.83 mg/L @ 25 °C (est)   Organoleptic Properties: Odor Type: citrus Odor Strength:medium Substantivity:212 hour(s) at 100.00 % citrus lemon Odor Description:at 100.00 %. citric citralva citral lemon Odor and/or flavor descriptions from others (if found).   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   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 (E)-citrus nitrile 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):53243-60-0 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :1585264 National Institute of Allergy and Infectious Diseases:Data (E)-3-methyl-5-phenylpent-2-enenitrile Chemidplus:0053243600   References:   (E)-3-methyl-5-phenylpent-2-enenitrile NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 53243-60-0 Pubchem (cid): 1585264 Pubchem (sid): 135060881   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: 2926.90.0000 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these litsea cubeba fruit extract FR aldehydic aldehydic 2- methyl undecanal dimethyl acetal FR citronella 4,8- dimethyl-7-nonen-2-ol FR citrus abronia fragrance FR acetaldehyde citronellyl methyl acetal FR aldehydic nitrile FR backhousia citriodora leaf oil FR beta- bisabolol FL/FR citral FL/FR (E)- citral FL/FR (Z)- citral FL/FR citral / methyl anthranilate schiff's base FR citral dimethyl acetal FL/FR citral ethylene glycol acetal FR citral propylene glycol acetal FL/FR citronella oil ceylon FL/FR citronellyl nitrile FR citrus limon extract FL/FR citrus limon flower/leaf/stem extract FR citrus limon fruit extract FL/FR citrus limon fruit oil FL/FR citrus limon fruit water FL/FR citrus limon juice extract FL/FR citrus limon juice powder FL/FR citrus limon peel extract FL/FR citrus limon peel oil c.p. florida FL/FR citrus limon peel oil expressed FL/FR citrus limon peel tincture FL/FR crithmum maritimum oil FR citrus floral fragrance FR homo geranyl nitrile FR lemon absolute replacer FR lemon balm fragrance FR lemon essence (oil phase) FL/FR lemon essence (water phase) FL/FR lemon fragrance FR lemon hexadiene FL/FR lemon oil FL/FR citral-less lemon oil FL/FR lemon oil c.p. africa FL/FR lemon oil c.p. argentina FL/FR lemon oil c.p. brazil FL/FR lemon oil c.p. california FL/FR lemon oil c.p. furocoumarin reduced FL/FR meyer lemon oil cold pressed FL/FR lemon oil decolorized FL/FR lemon oil folded FL/FR lemon oil folded argentina FL/FR lemon oil folded brazil FL/FR lemon oil folded california FL/FR lemon oil folded italy FL/FR lemon oil italy FL/FR lemon oil replacer FR lemon oil residues FL/FR lemon oil terpeneless FL/FR lemon oil terpenes FL/FR lemon oil washed FL/FR lemon specialty FL/FR lemongrass oil FL/FR lemongrass oil guatemala FL/FR lime oil fractions FR litsea cubeba fruit oil FL/FR litsea cubeba oil terpeneless FL/FR mandarin lemon fagrance FR (Z+E)-2- methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde FL/FR alpha- methylene citronellal FR ocimenol FL/FR petitgrain combava oil FR lemon scented tea tree oil FR tetrahydrocitral FL/FR trimethyl cyclohexene FR verbena oil replacer FR verbena oil spain FL/FR verbena oil terpeneless FL/FR verbena specialty FR floral aeolanthus graveolens oil FR alpha- amyl cinnamaldehyde dimethyl acetal FL/FR iso amyl geranate FR lemon oil distilled FL/FR nerol FL/FR petitgrain lemon oil FL/FR phenyl amyl alcohol FL/FR fruity amyl heptanoate FL/FR eucalyptus staigeriana oil FR green citral / diisotridecyl acetal FR iso decanal FL/FR neogall FR herbal canarium luzonicum gum FL/FR canarium luzonicum oil FL/FR medicinal kunzea ericoides leaf oil FR spicy piper longum fruit oil FL/FR piper longum fruit oil CO2 extract FL/FR terpenic elemi resinoid FL/FR gamma- terpinene FL/FR woody (E+Z)-4,8- dimethyl-3,7-nonadien-2-ol FL/FR alpha- terpinene FL/FR For Flavor No flavor group found for these alpha- amyl cinnamaldehyde dimethyl acetal FL/FR citral propylene glycol acetal FL/FR citrus limon juice powder FL/FR iso decanal FL/FR (E+Z)-4,8- dimethyl-3,7-nonadien-2-ol FL/FR lemon oil residues FL/FR lemon specialty FL/FR (Z+E)-2- methyl-2-(4-methyl-3-pentenyl) cyclopropane carbaldehyde FL/FR ocimenol FL/FR phenyl amyl alcohol FL/FR tetrahydrocitral FL/FR citrus citrus beta- bisabolol FL/FR citral FL/FR (E)- citral FL/FR (Z)- citral FL/FR citral dimethyl acetal FL/FR citronella oil ceylon FL/FR citrus limon extract FL/FR citrus limon fruit extract FL/FR citrus limon fruit oil FL/FR citrus limon fruit water FL/FR citrus limon juice extract FL/FR citrus limon peel extract FL/FR citrus limon peel oil c.p. florida FL/FR citrus limon peel oil expressed FL/FR citrus limon peel tincture FL/FR lemon essence (oil phase) FL/FR lemon essence (water phase) FL/FR lemon hexadiene FL/FR lemon oil FL/FR citral-less lemon oil FL/FR lemon oil c.p. africa FL/FR lemon oil c.p. argentina FL/FR lemon oil c.p. brazil FL/FR lemon oil c.p. california FL/FR lemon oil c.p. furocoumarin reduced FL/FR meyer lemon oil cold pressed FL/FR lemon oil decolorized FL/FR lemon oil distilled FL/FR lemon oil folded FL/FR lemon oil folded argentina FL/FR lemon oil folded brazil FL/FR lemon oil folded california FL/FR lemon oil folded italy FL/FR lemon oil italy FL/FR lemon oil terpeneless FL/FR lemon oil terpenes FL/FR lemon oil washed FL/FR lemongrass oil FL/FR lemongrass oil guatemala FL/FR litsea cubeba fruit oil FL/FR nerol FL/FR petitgrain lemon oil FL/FR verbena oil spain FL/FR verbena oil terpeneless FL/FR fruity amyl heptanoate FL/FR piper longum fruit oil CO2 extract FL/FR green canarium luzonicum gum FL/FR canarium luzonicum oil FL/FR elemi resinoid FL/FR lemon litsea cubeba oil terpeneless FL/FR spicy piper longum fruit oil FL/FR terpenic gamma- terpinene FL/FR alpha- terpinene FL/FR   Potential Uses: None Found   Occurrence (nature, food, other):note   not found in nature   Synonyms: (E)- citronitrile (E)- citrus nitrile (E)-3- methyl-5-phenyl pent-2-ene nitrile (2E)-3- methyl-5-phenyl-2-pentene nitrile (E)-3- methyl-5-phenyl-2-pentene nitrile (E)-3- methyl-5-phenylpent-2-enenitrile   Articles:   None found yet. 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Notes: None found

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