autumn carboxylate
calyxol (Quest)
 
Notes:
None found
  • Lluch Essence
    • Lluch Essence S.L.
      A family company dedicated to sales and distribution
      Flexibility, availability, price and quality.
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      Product(s):
      CALYXOL
       
  • Penta International
    • Penta International Corporation
      Chemistry innovation
      At Penta, our products and services help businesses do business better.
      For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
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      Product(s):
      05-52600 ETHYL-2-METHYL-6-PENTYL-4-OXOCYCLOHEX-2-ENE CARBOXYLATE
       
  • Vigon International
    • Vigon International
      Passion for Simplicity
      Manufacturer and supplier of high quality flavor and fragrance ingredients.
      The growth and success of Vigon is due in large part to a unique corporate concept that Vigon has developed and established within the industry: Creative Partnerships. This partnership concept has been and continues to be the foundation and guiding principle for all of Vigon's activities.
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      Product(s):
      503264 Calyxol
       
Synonyms   Articles   Notes   Search
CAS Number: 59151-19-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 261-629-6
Nikkaji Web: J308.631C
XlogP3-AA: 3.30 (est)
Molecular Weight: 252.35388000
Formula: C15 H24 O3
NMR Predictor: Predict (works with chrome 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
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 96.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 0.98600 to 0.99600 @  25.00 °C.
Pounds per Gallon - (est).: 8.205 to  8.288
Refractive Index: 1.47500 to 1.48100 @  20.00 °C.
Boiling Point: 244.00 to  245.00 °C. @ 760.00 mm Hg
Flash Point: 210.00 °F. TCC ( 98.89 °C. )
logP (o/w): 3.439 (est)
Soluble in:
 alcohol
 water, 7.423 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: floral
 
Odor Strength: medium
 
Substantivity: 24 hour(s) at 100.00 %
 
 sweet  anise  floral  clean  autumn  jasmin  
Odor Description:
at 100.00 %. 
sweet anise floral clean autumn jasmin
Luebke, William tgsc, (1985)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
Lluch Essence
CALYXOL
Penta International
ETHYL-2-METHYL-6-PENTYL-4-OXOCYCLOHEX-2-ENE CARBOXYLATE
Vigon International
Calyxol
Odor: Sweet anise floral clean autaum
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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
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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 autumn carboxylate usage levels up to:
  20.0000 % in the fragrance concentrate.
 
Recommendation for autumn carboxylate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 59151-19-8
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 100968
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate
Chemidplus: 0059151198
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References:
 ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 59151-19-8
Pubchem (cid): 100968
Pubchem (sid): 135057685
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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: 2910.30.000
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
No odor group found for these
 dehydro-ar-ionene 
aldehydic
 citronellyl oxyacetaldehydeFL/FR
(Z)-8-undecenalFR
anise
 anise oleoresinFL/FR
 anise seed oilFL/FR
star anise seed oil chinaFL/FR
 anise seed oil colombiaFL/FR
star anise seed oil terpenelessFL/FR
sweet fennel absoluteFL/FR
sweet fennel oleoresinFL/FR
anisic
para-acetanisoleFL/FR
ortho-acetanisoleFL/FR
 amyl furoateFL/FR
para-anisyl phenyl acetateFL/FR
para-anisyl propanalFR
 dihydroanetholFL/FR
 ethyl para-anisateFL/FR
 ocimum basilicum herb oilFL/FR
 sassafras acetateFL/FR
balsamic
2-phenyl propyl alcoholFL/FR
citrus
 dihydromyrcenolFL/FR
floral
alpha-amyl cinnamyl acetateFL/FR
 anise indeneFR
 anisyl propanal / methyl anthranilate schiff's baseFR
 benzyl acetoneFL/FR
 benzyl phenyl acetateFL/FR
 cyclohexyl ethyl alcoholFL/FR
 decyl formateFR
(E,E)-digeranyl etherFL/FR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinolFL/FR
 floral pyranolFR
 geranyl anthranilateFR
 hawthorn acetateFR
 honeysuckle absoluteFR
 hydroxycitronellolFL/FR
 jasmin absolute (from pommade)FL/FR
 jasmin absolute china (from concrete)FL/FR
 jasmin absolute egypt (from concrete)FL/FR
 jasmin absolute india (from concrete)FL/FR
 jasmin absolute italy (from concrete)FL/FR
 jasmin absolute sambacFL/FR
 jasmin acetateFL/FR
 jasmin pyranolFR
para-jasmoneFR
ortho-methyl acetophenoneFL/FR
 methyl dihydrojasmonateFL/FR
 muguet carboxaldehydeFR
 muguet shiseolFL/FR
cis-muguet shiseolFL/FR
bitter orangeflower absolute moroccoFL/FR
 pentenyl cyclopentanoneFR
 petitgrain mandarin oil terpenelessFL/FR
1-phenyl propyl butyrateFL/FR
isopropyl phenyl acetateFL/FR
 tuberose absolute (from concrete)FL/FR
 tuberose absolute (from pommade)FL/FR
 wallflower absoluteFR
fruity
para-anisyl methyl ketoneFL/FR
 benzyl propionateFL/FR
 berry hexanoateFR
(E,E)-ethyl sorbateFL/FR
 heptyl butyrateFL/FR
 styralyl butyrateFL/FR
green
 tiglaldehydeFL/FR
 tiglyl tiglateFR
herbal
 floral nitrileFR
licorice
(E)-anetholFL/FR
 clausena anisata leaf oil 
musk
 musk gx 50% in DEPFR
 musk gx 50% in DPGFR
 musk gx 50% in IPMFR
spicy
alpha-amyl cinnamyl alcoholFL/FR
waxy
 decyl acetateFL/FR
woody
 patchouli ethanoneFR
 
For Flavor
 
No flavor group found for these
 amyl furoateFL/FR
 clausena anisata leaf oil 
 dehydro-ar-ionene 
(E,E)-digeranyl etherFL/FR
4-ethyl anisoleFL
1-phenyl propyl butyrateFL/FR
anise
(E)-anetholFL/FR
 anise oleoresinFL/FR
 anise seed oilFL/FR
star anise seed oil chinaFL/FR
 anise seed oil colombiaFL/FR
star anise seed oil terpenelessFL/FR
 ethyl para-anisateFL/FR
sweet fennel absoluteFL/FR
sweet fennel oleoresinFL/FR
anisic
para-acetanisoleFL/FR
para-anisyl phenyl acetateFL/FR
ortho-methyl acetophenoneFL/FR
citrus
 citronellyl oxyacetaldehydeFL/FR
earthy
alpha-amyl cinnamyl acetateFL/FR
floral
 jasmin absolute (from pommade)FL/FR
 jasmin absolute china (from concrete)FL/FR
 jasmin absolute egypt (from concrete)FL/FR
 jasmin absolute india (from concrete)FL/FR
 jasmin absolute italy (from concrete)FL/FR
 jasmin absolute sambacFL/FR
 jasmin acetateFL/FR
 methyl dihydrojasmonateFL/FR
 muguet shiseolFL/FR
cis-muguet shiseolFL/FR
bitter orangeflower absolute moroccoFL/FR
 tuberose absolute (from concrete)FL/FR
 tuberose absolute (from pommade)FL/FR
fruity
 benzyl acetoneFL/FR
 benzyl propionateFL/FR
 dimethyl anthranilateFL/FR
(E,E)-ethyl sorbateFL/FR
 petitgrain mandarin oil terpenelessFL/FR
 styralyl butyrateFL/FR
 tiglaldehydeFL/FR
green
 cyclohexyl ethyl alcoholFL/FR
 dihydromyrcenolFL/FR
 heptyl butyrateFL/FR
2-phenyl propyl alcoholFL/FR
herbal
 dihydroanetholFL/FR
 ocimum basilicum herb oilFL/FR
honey
 benzyl phenyl acetateFL/FR
isopropyl phenyl acetateFL/FR
licorice
2-butyl-3-methyl pyrazineFL
medicinal
 dimethyl benzyl carbinolFL/FR
powdery
ortho-acetanisoleFL/FR
 hydroxycitronellolFL/FR
 powdery ketoneFL
spicy
alpha-amyl cinnamyl alcoholFL/FR
para-anisyl methyl ketoneFL/FR
tarragon
 sassafras acetateFL/FR
waxy
 decyl acetateFL/FR
 
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Potential Uses:
 amberFR
 autumnFR
 calyx 
 incenseFR
 jasminFR
 orchidFR
 peachFR
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 autumn carboxylate
 calyxol (Quest)
2-cyclohexene-1-carboxylic acid, 2-methyl-4-oxo-6-pentyl-, ethyl ester
 ethyl 2-methyl-4-oxo-6-pentyl cyclohex-2-ene carboxylate
 ethyl 2-methyl-4-oxo-6-pentyl cyclohex-2-ene-1-carboxylate
 ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate
 ethyl 2-methyl-6-pentyl-4-oxocyclohex-2-ene-1-carboxylate
 ethyl 2-methyl-6-pentyl-4-oxocyclohex-2-enecarboxylate
 ethyl-2-methyl-6-pentyl-4-oxocyclohex-2-ene carboxylate
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