plum damascone (high alpha)
isodamascone (high alpha) (Symrise)

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  Symrise AG

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  502512 Isodamascon

Fragrance Demo Formulas Name: (E)-1-(2,4,4-trimethylcyclohex-2-en-1-yl)but-2-en-1-one CAS Number: 39872-57-6 3D/inchi ECHA EINECS - REACH Pre-Reg: 254-663-8 FDA UNII: Search Nikkaji Web: J261.465K XlogP3-AA: 3.30 (est) Molecular Weight: 192.30160000 Formula: C13 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 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: 90.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.91800 to 0.92600 @ 25.00 °C. Pounds per Gallon - (est).: 7.639 to 7.705 Refractive Index: 1.48500 to 1.49300 @ 20.00 °C. Boiling Point: 266.00 to 267.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.008000 mmHg @ 25.00 °C. (est) Vapor Density: 6.7 ( Air = 1 ) Flash Point: > 200.00 °F. TCC ( > 93.33 °C. ) logP (o/w): 3.436 (est) Shelf Life: 12.00 month(s) or longer if stored properly. Storage: store in cool, dry place in tightly sealed containers, protected from heat and light. Soluble in:   alcohol   water, 10.31 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: fruity Odor Strength:high , recommend smelling in a 10.00 % solution or less Substantivity:128 hour(s) at 100.00 % fruity floral plum rose tobacco Odor Description:at 10.00 % in dipropylene glycol. fruity floral plum rose tobacco Odor and/or flavor descriptions from others (if found). Symrise Isodamascon® Odor Description:radiant floral-fruity, rosy Stable in: body lotion (good), shampoo (good), soap (good), ap roll-on (very good), powder (good), cleaner citric (good), cleaner apc (good), bleach (poor).   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers: Augustus Oils Iso Damascone Services Indukern F&F ISODAMASCONE Odor: FRUITY, FLORAL, ROSY Lluch Essence ISODAMASCONE Moellhausen ISODAMASCONE Organica Aromatics isoDAMASCONE NLT 90%(sum of isomers) Penta International ISODAMASCONE Symrise Isodamascon® Odor: radiant floral-fruity, rosy Use: Stable in: body lotion (good), shampoo (good), soap (good), ap roll-on (very good), powder (good), cleaner citric (good), cleaner apc (good), bleach (poor). Vigon International Isodamascon   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: oral-rat LD50 6300 mg/kg Stable in: body lotion (good), shampoo (good), soap (good), ap roll-on (very good), powder (good), cleaner citric (good), cleaner apc (good), bleach (poor). 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: Dermal sensitization IFRA fragrance material specification:   Should not be used as fragrance ingredients such that the total level in finished cosmetic products exceeds 0.02%, individually or in combination. Based on test data showing sensitising potential for these materials and on evidence of cross-reactivity. (IFRA guidelines)   View the IFRA Standard View IFRA Standards Library for complete information. Please review Amendment 49 IFRA documentation for complete information. IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%): Category 1: Products applied to the lips 0.0077 % Category 2: Products applied to the axillae 0.0023 % Category 3: Products applied to the face/body using fingertips 0.046 % Category 4: Products related to fine fragrance 0.043 %   Category 5: Products applied to the face and body using the hands (palms), primarily leave-on Category 5A: Body lotion products applied to the body using the hands (palms), primarily leave-on 0.011 % Category 5B: Face moisturizer products applied to the face using the hands (palms), primarily leave-on 0.011 % Category 5C: Hand cream products applied to the hands using the hands (palms), primarily leave-on 0.011 % Category 5D: Baby Creams, baby Oils and baby talc 0.011 % Category 6: Products with oral and lip exposure 0.025 %   Category 7: Products applied to the hair with some hand contact Category 7A: Rinse-off products applied to the hair with some hand contact 0.088 % Category 7B: Leave-on products applied to the hair with some hand contact 0.088 % Category 8: Products with significant anogenital exposure 0.0045 % Category 9: Products with body and hand exposure, primarily rinse off 0.084 %   Category 10: Household care products with mostly hand contact Category 10A: Household care excluding aerosol products (excluding aerosol/spray products) 0.30 % Category 10B: Household aerosol/spray products 0.30 %   Category 11: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate Category 11A: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure 0.17 % Category 11B: Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure 0.17 % Category 12: Products not intended for direct skin contact, minimal or insignificant transfer to skin No Restriction   Notes: IFRA FLAVOR REQUIREMENTS: Due to the possible ingestion of small amounts of fragrance ingredients from their use in products in Categories 1 and 6, materials must not only comply with IFRA Standards but must also be recognized as safe as a flavoring ingredient as defined by the IOFI Code of Practice (www.iofi.org). For more details see chapter 1 of the Guidance for the use of IFRA Standards. use level in formulae for use in cosmetics:   0.0380 % Dermal Systemic Exposure in Cosmetic Products:   0.0010 mg/kg/day (IFRA, 2002)   Recommendation for plum damascone (high alpha) flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View EPA Substance Registry Services (TSCA):39872-57-6 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :6438067 National Institute of Allergy and Infectious Diseases:Data SCCNFP:opinion WGK Germany:2 (E)-1-(2,4,4-trimethylcyclohex-2-en-1-yl)but-2-en-1-one Chemidplus:0039872576   References:   (E)-1-(2,4,4-trimethylcyclohex-2-en-1-yl)but-2-en-1-one NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 39872-57-6 Pubchem (cid): 6438067 Pubchem (sid): 135073936   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   Potential Blenders and core components note For Odor No odor group found for these (E+Z)-4,8- dimethyl-3,7-nonadien-2-one FL/FR aldehydic aldehydic 3- methyl-4-hexyl oxybutyraldehyde FR balsamic benzyl cinnamate FL/FR cinnamyl formate FL/FR guaiyl butyrate FR caramellic maltyl isobutyrate FL/FR citrus (R)- citronellyl nitrile FR citronitrile (Symrise) FR 2- heptanol FL/FR ethereal iso valeraldehyde propylene glycol acetal FL/FR fatty butyl undecylenate FL/FR 4- ethyl octanoic acid FL/FR fermented methyl decanoate FL/FR floral acetal 318 FR iso amyl angelate FL/FR alpha- amyl cinnamaldehyde FL/FR benzyl acetate FL/FR benzyl acetoacetate FL/FR benzyl formate FL/FR benzyl isobutyrate FL/FR blue lagoon fragrance FR citronellyl acetate FL/FR (S)- citronellyl acetate FL/FR citronellyl butyrate FL/FR citronellyl hexanoate FL/FR citronellyl propionate FL/FR (E)- citronellyl tiglate FL/FR 3- cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester FR cymbopogon validus leaf oil FR beta- damascenone FL/FR dihydrojasmone FL/FR dimethyl benzyl carbinyl acetate FL/FR 3,6- dimethyl-3-octyl acetate FR ethyl anthranilate FL/FR ethyl ethyl anthranilate FL/FR eucalyptus macarthurii oil FR geraniol FL/FR geranyl isobutyrate FL/FR geranyl propionate FL/FR hibiscus fragrance FR ionone mixed isomers FL/FR jasmin cyclopentanone FR iso jasmone FL/FR linalyl butyrate FL/FR magnolia flower oil CO2 extract FL/FR magnolia specialty FR menthadienyl formate FR ortho- methoxybenzyl ethyl ether FR methoxymelonal FL/FR 1-(2- methyl allyl oxy)-3-methoxy-3-methyl-1-butane FR para- methyl benzyl acetate FL/FR methyl benzyl acetate (mixed ortho-,meta-,para-) FL/FR alpha-iso methyl ionone (90% min.) FL/FR methyl ionyl acetate FL/FR pink nelumbo nucifera flower absolute FR white nelumbo nucifera flower absolute FR white nelumbo nucifera flower concrete FR 3- nonanon-1-yl acetate FL/FR orris rhizome concrete butter (iris pallida) FL/FR osmanthus absolute replacer FR osmanthus concrete FL/FR petitgrain lemon oil FL/FR petitgrain mandarin oil FL/FR phenethyl acetate FL/FR phenethyl isobutyrate FL/FR phenethyl isovalerate FL/FR 1- phenyl propyl butyrate FL/FR 2- phenyl propyl isobutyrate FL/FR 4- phenyl-3-buten-2-ol FL/FR plum damascone FR iso propyl benzoate FL/FR rhodinyl butyrate FL/FR rose undecene FR souroubea specialty FR star fruit oil cuba FL/FR styralyl propionate FL/FR terpinyl valerate FL/FR tetrahydroionyl acetate FR fruity allyl benzoate FR iso amyl propionate FL/FR apricot essence FL/FR apricot isobutyrate FR benzaldehyde / methyl anthranilate schiff's base FR benzyl propionate FL/FR benzyl valerate FL/FR berry hexanoate FR butyl 2-naphthyl ether FL/FR iso butyl anthranilate FL/FR iso butyl furyl propionate FL/FR citronellyl isobutyrate FL/FR (Z)-beta- damascone FL/FR (E)-beta- damascone FL/FR beta- damascone FL/FR (R)-gamma- dodecalactone FL/FR eriocephalus punctulatus flower oil FR ethyl levulinate FL/FR ginsene FR heptyl isobutyrate FL/FR linalool oxide acetates FL/FR 3- mercaptohexyl acetate FL/FR methyl (Z)-3-hexenoate FL/FR methyl bicycloheptenyl methyloxirane carboxylate FR methyl isobutyrate FL/FR (E)-7- methyl-3-octen-2-one FL/FR (±)-3- methyl-gamma-decalactone FL/FR myrascone FR 2- nonanone propylene glycol acetal FL/FR alpha- ocimene FL/FR peach nitrile FR propyl isobutyrate FL/FR rhubarb pyran FR sambucus canadensis fruit absolute FL/FR strawberry glycidate 1 (aldehyde C-16 (so-called)) FL/FR (R)- styralyl acetate FL/FR 4-(para- tolyl)-2-butanone FL/FR tropical indene FR tropical ionone FL/FR tropical thiazole FL/FR cis- woody acetate FR green iso amyl 3-(2-furan) propionate FL/FR ethyl (E,Z)-2,4-decadienoate FL/FR heptanal dimethyl acetal FL/FR (Z)-3- hexen-1-yl isovalerate FL/FR hexoxyacetaldehyde dimethyl acetal FR 1- penten-3-ol FL/FR 1-[(3aS,7aR)-3a,4,7,7a- tetrahydro-1H-inden-6-yl]ethanone FR herbal chamomile isobutyrate FR chamomile propionate FR chamomile valerate FR clary propyl acetate FR geranium cyclohexane FR methyl cyclogeranate (Firmenich) FR tagete oil madagascar FL/FR viridiflorol FL/FR medicinal ortho- cresyl acetate FL/FR powdery alpha- methyl ionone FL/FR (E)-alpha- methyl ionone (74-80%) FL/FR spicy para- anisyl formate FL/FR spicy acetoacetate FL/FR sulfurous buchu mercaptan FL/FR cassis pentanone FL/FR passiflora acetate FL/FR tropical beta- cyclocitral FL/FR triflaige A (ZEON) FR tropical 3-thiobutyrate FL/FR waxy dihydrocitronellyl acetate FL/FR (E)- methyl geranate FL/FR phytyl acetate FL/FR woody 2- decalinyl acetate FR melozol acetate FR rhubarb oxirane FR yeasty 2- octen-4-one FL/FR For Flavor No flavor group found for these 1- acetyl cyclohexyl acetate FL iso amyl 3-methyl thiopropionate FL iso amyl angelate FL/FR benzyl valerate FL/FR butyl 2-naphthyl ether FL/FR 2- butyl thiophene FL ortho- cresyl acetate FL/FR 2,4- difurfuryl furan FL dihydrocitronellyl acetate FL/FR S-(2,5- dimethyl-3-furyl) ethane thioate FL (E+Z)-4,8- dimethyl-3,7-nonadien-2-one FL/FR (R)-gamma- dodecalactone FL/FR ethyl 3-octenoate FL ethyl ethyl anthranilate FL/FR ionone mixed isomers FL/FR linalool oxide acetates FL/FR magnolia flower oil CO2 extract FL/FR methyl benzyl acetate (mixed ortho-,meta-,para-) FL/FR (E)- methyl geranate FL/FR 2- nonanone propylene glycol acetal FL/FR alpha- ocimene FL/FR 1- phenyl propyl butyrate FL/FR 2- phenyl propyl isobutyrate FL/FR iso propyl benzoate FL/FR (R)- styralyl acetate FL/FR viridiflorol FL/FR iso amyl 3-(2-furan) propionate FL/FR benzyl acetoacetate FL/FR iso butyl furyl propionate FL/FR beta- damascone FL/FR alliaceous alliaceous tropical thiazole FL/FR berry heptyl isobutyrate FL/FR burnt ethyl 2-furoate FL cheesy methyl ketones FL citrus petitgrain lemon oil FL/FR petitgrain mandarin oil FL/FR styralyl propionate FL/FR ethereal methyl isobutyrate FL/FR fatty 4- ethyl octanoic acid FL/FR methyl decanoate FL/FR (E)-7- methyl-3-octen-2-one FL/FR floral citronellyl acetate FL/FR (S)- citronellyl acetate FL/FR citronellyl hexanoate FL/FR citronellyl propionate FL/FR dihydrojasmone FL/FR dimethyl benzyl carbinyl acetate FL/FR geraniol FL/FR geranyl isobutyrate FL/FR linalyl butyrate FL/FR (E)-alpha- methyl ionone (74-80%) FL/FR alpha-iso methyl ionone (90% min.) FL/FR orris rhizome concrete butter (iris pallida) FL/FR rhodinyl butyrate FL/FR tropical ionone FL/FR fruity iso amyl propionate FL/FR apricot essence FL/FR benzyl acetate FL/FR benzyl formate FL/FR benzyl isobutyrate FL/FR benzyl propionate FL/FR iso butyl anthranilate FL/FR citronellyl butyrate FL/FR citronellyl isobutyrate FL/FR (E)-beta- damascone FL/FR (Z)-beta- damascone FL/FR ethyl anthranilate FL/FR ethyl levulinate FL/FR 2- heptanol FL/FR 2- hexyl-4-acetoxytetrahydrofuran FL methoxymelonal FL/FR methyl (Z)-3-hexenoate FL/FR methyl 4-phenyl butyrate FL para- methyl benzyl acetate FL/FR alpha- methyl ionone FL/FR 3- nonanon-1-yl acetate FL/FR osmanthus concrete FL/FR phenethyl isovalerate FL/FR 2- phenyl-4-pentenal FL propyl isobutyrate FL/FR sambucus canadensis fruit absolute FL/FR star fruit oil cuba FL/FR strawberry glycidate 1 (aldehyde C-16 (so-called)) FL/FR tagete oil madagascar FL/FR terpinyl valerate FL/FR 4-(para- tolyl)-2-butanone FL/FR iso valeraldehyde propylene glycol acetal FL/FR green cassis pentanone FL/FR (E)- citronellyl tiglate FL/FR ethyl (E,Z)-2,4-decadienoate FL/FR heptanal dimethyl acetal FL/FR (Z)-3- hexen-1-yl isovalerate FL/FR iso jasmone FL/FR 1- penten-3-ol FL/FR honey phenethyl acetate FL/FR phenethyl isobutyrate FL/FR jammy maltyl isobutyrate FL/FR nutty phytyl acetate FL/FR spicy para- anisyl formate FL/FR benzyl cinnamate FL/FR cinnamyl formate FL/FR spicy acetoacetate FL/FR sulfurous buchu mercaptan FL/FR methyl 2-(methyl thio) butyrate FL methyl thiomethyl butyrate FL tropical 3-thiobutyrate FL/FR tropical alpha- amyl cinnamaldehyde FL/FR beta- cyclocitral FL/FR 3- mercaptohexyl acetate FL/FR passiflora acetate FL/FR vegetable 2- octen-4-one FL/FR waxy butyl undecylenate FL/FR geranyl propionate FL/FR (±)-3- methyl-gamma-decalactone FL/FR 4- phenyl-3-buten-2-ol FL/FR woody beta- damascenone FL/FR methyl ionyl acetate FL/FR   Potential Uses: FR floral FR plum FR rose FR tobacco   Occurrence (nature, food, other):note   not found in nature   Synonyms: 2- buten-1-one, 1-(2,4,4-trimethyl-2-cyclohexen-1-yl)-, (2E)- 2- buten-1-one, 1-(2,4,4-trimethyl-2-cyclohexen-1-yl)-, (E)- iso damascone (high alpha) (Symrise) iso damascone (Symrise)   plum damascone (high alpha) (E)- rose ketone-5 (E)-1-(2,4,4- trimethyl-2-cyclohexen-1-yl)-2-buten-1-one (E)-(2,4,4- trimethyl-2-cyclohexenyl)-2-butenone trans-(2,4,4- trimethyl-2-cyclohexenyl)-2-butenone (2E)-1-(2,4,4- trimethylcyclohex-2-en-1-yl)but-2-en-1-one (E)-1-(2,4,4- trimethylcyclohex-2-en-1-yl)but-2-en-1-one   Articles:   None found yet. Try the PubMed Search.

Notes: None found