(E)-isoeugenol
trans-p-propenylguaiacol

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Name: 2-methoxy-4-[(E)-prop-1-enyl]phenol CAS Number: 5932-68-3 3D/inchi ECHA EINECS - REACH Pre-Reg: 227-678-2 FDA UNII: 28FSR1NAY4 Nikkaji Web: J53.761F Beilstein Number: 2046156 MDL: MFCD00009285 XlogP3: 2.60 (est) Molecular Weight: 164.20404000 Formula: C10 H12 O2 BioActivity Summary: listing 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: colorlss to pale yellow clear viscous liquid to solid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Melting Point: 32.00 to 34.00 °C. @ 760.00 mm Hg Boiling Point: 266.00 to 268.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.005000 mmHg @ 25.00 °C. (est) Flash Point: 253.00 °F. TCC ( 122.78 °C. ) logP (o/w): 2.451 (est) Soluble in:   alcohol   water, 165.9 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: spicy sweet spicy carnation phenolic floral Odor Description:at 100.00 %. sweet spicy carnation phenolic floral Luebke, William tgsc, (1985) Odor sample from: Chem-Fleur, Inc. Odor and/or flavor descriptions from others (if found).   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers: Sigma-Aldrich For experimental / research use only. Isoeugenol, predominantly trans analytical standard   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: intraperitoneal-mouse LD50 540 mg/kg Chem-Fleur, Inc. intraperitoneal-mouse LD50 540 mg/kg Food and Cosmetics Toxicology. Vol. 13, Pg. 815, 1975. 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 IFRA Critical Effect: Sensitization limits in the finished product for - "leave on the skin contact":   0.0200 % Restriction. limits in the finished product for - "wash off the skin contact":   0.0200 % Restriction. limits in the finished product for - "no skin contact":   0.2000 % Restriction. Recommendation for (E)-isoeugenol usage levels up to:   2.0000 % in the fragrance concentrate.   Recommendation for (E)-isoeugenol 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 :853433 National Institute of Allergy and Infectious Diseases:Data SCCNFP:opinion WGK Germany:2 2-methoxy-4-[(E)-prop-1-enyl]phenol Chemidplus:0005932683   References:   2-methoxy-4-[(E)-prop-1-enyl]phenol NIST Chemistry WebBook: Search Inchi Pubchem (cid): 853433 Pubchem (sid): 134970634 Flavornet: 5932-68-3 Pherobase: View   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 CHEBI: View CHEMBL: View KEGG (GenomeNet): C10469 HMDB (The Human Metabolome Database): HMDB05802 FooDB: FDB012403 YMDB (Yeast Metabolome Database): YMDB01677 Export Tariff Code: 2909.50.4010 Typical G.C. VCF-Online: VCF Volatile Compounds in Food ChemSpider: View Wikipedia: View   Potential Blenders and core components note For Odor floral cardamom absolute FL/FR cassie absolute FL/FR cassie absolute replacer FL/FR cassie perfume base FR cestrum nocturnum flower absolute FR champaca absolute FR para- cresyl acetate FL/FR daffodil fragrance FR dianthus fragrance FR iso eugenyl ethyl acetal FR guaethol allyl ether FR heliotropyl diethyl acetal FR (Z)- jasmone FL/FR phenethyl salicylate FL/FR phenyl amyl alcohol FL/FR rose oil (rosa damascena) bulgaria FL/FR tobacco flower absolute FR tuberose absolute (from concrete) FL/FR tuberose absolute (from pommade) FL/FR wallflower absolute FR ylang ylang flower absolute FL/FR fruity cinnamyl isobutyrate FL/FR green marigold pot absolute FL/FR herbal clary sage absolute FL/FR american elder flower absolute FR minty homo menthyl acetate FL/FR orris iso eugenyl formate FL/FR phenolic para-alpha- dimethyl styrene FL/FR methyl benzoate FL/FR spicy allspice berry absolute FL/FR allspice berry oil FL/FR allspice berry oil terpeneless FL/FR allspice fragrance FR allspice leaf oil FL/FR allspice leaf oil terpeneless FL/FR allspice oil FL/FR allspice oleoresin FL/FR amyl isoeugenol FR homo anisaldehyde FL/FR bay oil replacer FR benzyl isoeugenol FL/FR calamus leaf oil FR cananga leaf oil FR canella bark oil FR carnation specialty FR beta- caryophyllene FL/FR caryophyllene FL/FR cinnamomum culilawan bark oil FR cinnamomum culilawan leaf oil FR cinnamon leaf oil FL/FR terpeneless cinnamon leaf oil FL/FR cinnamon leaf oil ceylon FL/FR cinnamon leaf oil replacer FR cinnamyl acetate FL/FR clove bud absolute FL/FR clove bud concrete FR clove bud essence FL/FR clove bud oil FL/FR terpeneless clove bud oil FL/FR clove bud oil CO2 extract FL/FR clove bud oil replacer FR clove bud oleoresin FL/FR clove bud resinoid FL/FR clove fragrance FR clove leaf absolute FR clove leaf oil FL/FR clove leaf oil terpeneless FL/FR clove leaf resinoid FR clove stem oil FL/FR iso cyclogeraniol (IFF) FR dianthus ethone FR dihydroeugenol FL/FR 4- ethyl guaiacol FL/FR ethyl isoeugenol FL/FR eugenol FL/FR iso eugenol FL/FR eugenyl acetate FL/FR iso eugenyl acetate FL/FR eugenyl benzoate FL/FR eugenyl isovalerate FL/FR iso eugenyl phenyl acetate FL/FR eugenyl phenyl acetate FL/FR floral spice fragrance FR laurus nobilis leaf oil turkey FL/FR (E)-para- methoxycinnamaldehyde FL/FR methyl eugenol FR 4- methyl guaiacol FL/FR methyl isoeugenol FL/FR pepper tree berry oil FL/FR pimenta acris leaf oil FL/FR pimenta officinalis fruit extract FR syzygium aromaticum bud extract FL/FR syzygium aromaticum tincture FL/FR syzygium aromaticum water FL/FR zingerone FL/FR vanilla methyl vanillate FL/FR woody cedrela wood oil FR guaiacyl acetate FL/FR rhubarb oxirane FR For Flavor No flavor group found for these homo anisaldehyde FL/FR cassie absolute replacer FL/FR eugenyl benzoate FL/FR iso eugenyl formate FL/FR eugenyl isovalerate FL/FR eugenyl phenyl acetate FL/FR laurus nobilis leaf oil turkey FL/FR (E)-para- methoxycinnamaldehyde FL/FR methyl vanillate FL/FR phenyl amyl alcohol FL/FR syzygium aromaticum water FL/FR aromatic aromatic para- cresyl acetate FL/FR cooling homo menthyl acetate FL/FR floral cardamom absolute FL/FR rose oil (rosa damascena) bulgaria FL/FR tuberose absolute (from concrete) FL/FR tuberose absolute (from pommade) FL/FR ylang ylang flower absolute FL/FR fruity cinnamyl isobutyrate FL/FR green marigold pot absolute FL/FR herbal clary sage absolute FL/FR medicinal, phenethyl salicylate FL/FR phenolic methyl benzoate FL/FR spicy allspice berry absolute FL/FR allspice berry oil FL/FR allspice berry oil terpeneless FL/FR allspice leaf oil FL/FR allspice leaf oil terpeneless FL/FR allspice oil FL/FR allspice oleoresin FL/FR benzyl isoeugenol FL/FR beta- caryophyllene FL/FR caryophyllene FL/FR cassie absolute FL/FR cinnamon leaf oil FL/FR terpeneless cinnamon leaf oil FL/FR cinnamon leaf oil ceylon FL/FR cinnamyl acetate FL/FR clove bud absolute FL/FR clove bud essence FL/FR clove bud oil FL/FR terpeneless clove bud oil FL/FR clove bud oil CO2 extract FL/FR clove bud oleoresin FL/FR clove bud resinoid FL/FR clove leaf oil FL/FR clove leaf oil terpeneless FL/FR clove stem oil FL/FR dihydroeugenol FL/FR para-alpha- dimethyl styrene FL/FR ethyl isoeugenol FL/FR iso eugenol FL/FR eugenol FL/FR eugenyl acetate FL/FR iso eugenyl acetate FL/FR iso eugenyl phenyl acetate FL/FR 4- methyl guaiacol FL/FR methyl isoeugenol FL/FR pepper tree berry oil FL/FR pimenta acris leaf oil FL/FR syzygium aromaticum bud extract FL/FR syzygium aromaticum tincture FL/FR zingerone FL/FR woody 4- ethyl guaiacol FL/FR guaiacyl acetate FL/FR (Z)- jasmone FL/FR   Potential Uses: FR carnation FR clove FR spice   Occurrence (nature, food, other):note   cananga oil china @ 1.54% Data GC Search Trop Picture   clove bud Search Trop Picture   clove fruit Search Trop Picture   jasmin absolute china @ 28.94% Data GC Search Trop Picture   laurel leaf oil turkey @ 0.20% Data GC Search Trop Picture   mace oil CO2 extract @ 0.10% Data GC Search Trop Picture   nutmeg extract CO2 west indian @ trace% Data GC Search Trop Picture   nutmeg flower oil @ 0.56% Data GC Search Trop Picture   nutmeg leaf oil @ 0.00-0.40% Data GC Search Trop Picture   nutmeg oil Search Trop Picture   osmanthus absolute @ 0.02% Data GC Search Trop Picture   Synonyms: (E)-iso eugenol trans-iso eugenol iso eugenol E iso eugenol trans-form iso eugenol, (E)-isomer 2- methoxy-4-((E)-propenyl)-phenol trans-2- methoxy-4-(1-propenyl)phenol (E)-2- methoxy-4-(prop-1-en-1-yl)phenol (E)-2- methoxy-4-(prop-1-enyl) phenol trans-2- methoxy-4-(prop-1-enyl) phenol (E)-2- methoxy-4-(prop-1-enyl)phenol 2- methoxy-4-[(1E)-1-propen-1-yl]phenol 2- methoxy-4-[(1E)-prop-1-en-1-yl]phenol 2- methoxy-4-[(E)-prop-1-enyl]phenol (E)-2- methoxy-4-propenyl phenol trans-2- methoxy-4-propenyl phenol trans-2- methoxy-4-propenylphenol   phenol, 2-methoxy-4-(1-propenyl)-, (E)- (E)-p- propenyl guaiacol (E)-para- propenyl guaiacol trans-p- propenyl guaiacol trans-para- propenyl guaiacol (E)-para- propenylguaiacol trans-p- propenylguaiacol trans-para- propenylguaiacol (E)-p- propenylquaiacol trans-p- propenylquaiacol   Articles:   None found yet. Try the PubMed Search.

Notes: None found

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