(E)-cinnamyl butyrate
(E)-3-phenylprop-2-en-1-yl butanoate

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  CODE110642 CODE110642
  Product(s):
  W229601 trans-Cinnamyl butyrate, ≥96%, FCC
  SDS

Name: [(E)-3-phenylprop-2-enyl] butanoate CAS Number: 78761-39-4 3D/inchi FDA UNII: TKZ9V37P1G Nikkaji Web: J35.105I Beilstein Number: 3200585 MDL: MFCD00027135 CoE Number: 279 XlogP3-AA: 3.10 (est) Molecular Weight: 204.26892000 Formula: C13 H16 O2 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   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 96.00 to 100.00 Food Chemicals Codex Listed: Yes Specific Gravity: 1.01000 to 1.01500 @ 25.00 °C. Pounds per Gallon - (est).: 8.404 to 8.446 Refractive Index: 1.52500 to 1.53000 @ 20.00 °C. Boiling Point: 300.00 °C. @ 760.00 mm Hg Boiling Point: 174.00 °C. @ 20.00 mm Hg Acid Value: 1.00 max. KOH/g Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est) Flash Point: > 230.00 °F. TCC ( > 110.00 °C. ) logP (o/w): 3.660 (est) Soluble in:   alcohol   water, 22.29 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: balsamic Odor Strength:medium Substantivity:152 hour(s) at 100.00 % balsamic fruity cinnamyl Odor Description:at 100.00 %. soft balsam fruity cinnamyl Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: Sigma-Aldrich trans-Cinnamyl butyrate, ≥96%, FCC sds Odor: balsam; floral; fruity Certified Food Grade Products   Safety Information: Preferred SDS: View European information : Most important hazard(s): Xi - Irritant R 36/37/38 - Irritating to eyes, respiratory system, and skin. 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: 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 (E)-cinnamyl butyrate usage levels up to:   5.0000 % in the fragrance concentrate.   Recommendation for (E)-cinnamyl butyrate flavor usage levels up to:   15.0000 ppm in the finished product.   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 :5355254 National Institute of Allergy and Infectious Diseases:Data WGK Germany:2 [(E)-3-phenylprop-2-enyl] butanoate Chemidplus:0000103617 RTECS:ES8815000 for cas# 78761-39-4   References:   [(E)-3-phenylprop-2-enyl] butanoate NIST Chemistry WebBook: Search Inchi Pubchem (cid): 5355254 Pubchem (sid): 134972236   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: 2915.60.0000 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these cinnamyl valerate FL/FR balsamic balsamic iso amyl benzoate FL/FR benzyl cinnamate FL/FR butyl benzoate FL/FR iso butyl cinnamate FL/FR cinnamyl alcohol FL/FR cinnamyl benzoate FL/FR cinnamyl cinnamate FL/FR cinnamyl formate FL/FR ethyl cinnamate FL/FR (Z)-3- hexen-1-yl cinnamate FR hexyl cinnamate FR linalyl cinnamate FL/FR octyl benzoate FR octyl cinnamate FR peru balsam oil FL/FR 2- phenoxyethyl formate FR 3- phenyl propyl acetate FL/FR phenyl salicylate FR pine needle absolute FL/FR prenyl benzoate FL/FR iso propyl cinnamate FL/FR propyl cinnamate FL/FR terpinyl butyrate FL/FR tetrahydrofurfuryl cinnamate FL/FR coconut (R)-gamma- nonalactone FL/FR earthy octyl phenyl acetate FL/FR fatty (S)-gamma- decalactone FL/FR floral alpha- amyl cinnamyl acetate FL/FR benzyl acetone FL/FR benzyl alcohol FL/FR bois de rose oil brazil FL/FR cananga oil FL/FR cinnamyl phenyl acetate FL/FR coranol (Firmenich) FR dihydrolinalool FL/FR 3,6- dimethyl-3-octanol FL/FR ethyl linalool FR ethyl linalyl acetal FR ethyl linalyl acetate FR ethyl linalyl ether FL/FR geranyl phenyl acetate FL/FR ho leaf oil FR ho wood oil FR hydroxycitronellal FL/FR dextro- linalool FL/FR laevo- linalool FL/FR linalool FL/FR linalool oxide FL/FR linalyl anthranilate FL/FR methyl jasmonate FL/FR 4- phenyl-3-buten-2-ol FL/FR iso phytol FL/FR (Z,E)- phytol FL/FR tetrahydrolinalool FL/FR fruity allyl (E)-cinnamate FL/FR allyl cinnamate FL/FR balsam specialty FR cinnamyl hexanoate FL/FR cinnamyl isobutyrate FL/FR (E)- cinnamyl propionate FL/FR ethyl methyl anthranilate FL/FR nerolidyl isobutyrate FR 3- phenyl propyl isobutyrate FL/FR green acetaldehyde benzyl 2-methoxyethyl acetal FL/FR picea glauca leaf absolute FR spicy cinnamyl acetate FL/FR cinnamyl isovalerate FL/FR cinnamyl propionate FL/FR cubeb oil FL/FR (E)- propyl 2-furan acrylate FL/FR spicy acetoacetate FL/FR tobacco honey absolute FL/FR waxy phytyl acetate FL/FR woody cinnamyl tiglate FL/FR santalyl butyrate FL/FR For Flavor No flavor group found for these acetaldehyde benzyl 2-methoxyethyl acetal FL/FR allyl (E)-cinnamate FL/FR allyl cinnamate FL/FR butyl benzoate FL/FR cinnamyl benzoate FL/FR cinnamyl hexanoate FL/FR cinnamyl phenyl acetate FL/FR (E)- cinnamyl propionate FL/FR cinnamyl tiglate FL/FR cinnamyl valerate FL/FR (S)-gamma- decalactone FL/FR ethyl linalyl ether FL/FR ethyl methyl anthranilate FL/FR dextro- linalool FL/FR methyl furfuracrylate FL (R)-gamma- nonalactone FL/FR 3-oxo octanoic acid glyceride FL octyl phenyl acetate FL/FR pine needle absolute FL/FR prenyl benzoate FL/FR santalyl butyrate FL/FR tetrahydrofurfuryl cinnamate FL/FR balsamic balsamic iso butyl cinnamate FL/FR ethyl cinnamate FL/FR peru balsam oil FL/FR 3- phenyl propyl acetate FL/FR (Z,E)- phytol FL/FR iso propyl cinnamate FL/FR burnt ethyl 2-furoate FL citrus linalool FL/FR laevo- linalool FL/FR earthy alpha- amyl cinnamyl acetate FL/FR floral bois de rose oil brazil FL/FR cananga oil FL/FR cinnamyl propionate FL/FR dihydrolinalool FL/FR geranyl phenyl acetate FL/FR linalyl anthranilate FL/FR methyl jasmonate FL/FR terpinyl butyrate FL/FR tetrahydrolinalool FL/FR fruity iso amyl benzoate FL/FR benzyl acetone FL/FR benzyl alcohol FL/FR cinnamyl isobutyrate FL/FR cinnamyl isovalerate FL/FR linalyl cinnamate FL/FR 3- phenyl propyl isobutyrate FL/FR (E)- propyl 2-furan acrylate FL/FR propyl cinnamate FL/FR green cinnamyl alcohol FL/FR linalool oxide FL/FR herbal 3,6- dimethyl-3-octanol FL/FR honey honey absolute FL/FR nutty phytyl acetate FL/FR oily iso phytol FL/FR spicy benzyl cinnamate FL/FR cinnamyl acetate FL/FR cinnamyl cinnamate FL/FR cinnamyl formate FL/FR cubeb oil FL/FR spicy acetoacetate FL/FR waxy hydroxycitronellal FL/FR 4- phenyl-3-buten-2-ol FL/FR   Potential Uses: FR apple FR crabapple FR balsam FR banana FR floral FR honey FR lily FR lily of the valley FR peach FR pear FR rose FR sweet pea FR tuberose FL/FR valerian FR wisteria   Occurrence (nature, food, other):note   apple fruit Search PMC Picture   Synonyms:   butanoic acid, (2E)-3-phenyl-2-propen-1-yl ester trans- cinnamyl butyrate (2E)-3- phenylprop-2-en-1-yl butanoate (E)-3- phenylprop-2-en-1-yl butanoate (2E)-3- phenylprop-2-en-1-yl butyrate (E)-3- phenylprop-2-en-1-yl butyrate [(E)-3- phenylprop-2-enyl] butanoate   Articles:   None found yet. Try the PubMed Search.

Notes: None found