EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

autumn carboxylate
calyxol (Quest)

Sponsors

Name:ethyl 2-methyl-4-oxo-6-pentylcyclohex-2-ene-1-carboxylate
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
 
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
 
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 sample from: PPF Norda, Inc
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: perfuming agents
 
Suppliers:
CG Herbals
Calyxol
Odor: Soft Floral jasmine, with the suggestion of honeysuckle, citrus and fresh Lavender
Use: Used in all types of products. Typically 1 to 5% but upto 20% in toiletries and fine fragrances. Works well in combination with other jasmine notes. Particularly MDJ Super and Hexyl Cinnamic Aldehyde.
Lluch Essence
CALYXOL
Penta International
ETHYL-2-METHYL-6-PENTYL-4-OXOCYCLOHEX-2-ENE CARBOXYLATE
Vigon International
Calyxol
Odor: Sweet anise floral clean autaum
 
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
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.
 
Safety References:
EPI System: View
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
 
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
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2009
(IUPAC):Atomic Weights of the Elements 2009 (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
 
Potential Blenders and core components note
For Odor
aldehydic
citronellyl oxyacetaldehyde
FL/FR
(Z)-8-
undecenal
FR
anise
anise oleoresin
FL/FR
anise seed oil
FL/FR
star
anise seed oil china
FL/FR
anise seed oil colombia
FL/FR
star
anise seed oil terpeneless
FL/FR
sweet
fennel absolute
FL/FR
sweet
fennel oleoresin
FL/FR
anisic
para-
acetanisole
FL/FR
ortho-
acetanisole
FL/FR
amyl furoate
FL/FR
para-
anisyl phenyl acetate
FL/FR
para-
anisyl propanal
FR
dihydroanethol
FL/FR
ethyl para-anisate
FL/FR
ocimum basilicum herb oil
FL/FR
sassafras acetate
FL/FR
balsamic
2-
phenyl propyl alcohol
FL/FR
citrus
dihydromyrcenol
FL/FR
floral
alpha-
amyl cinnamyl acetate
FL/FR
anise indene
FR
anisyl propanal / methyl anthranilate schiff's base
FR
benzyl acetone
FL/FR
benzyl phenyl acetate
FL/FR
cyclohexyl ethyl alcohol
FL/FR
decyl formate
FR
(E,E)-
digeranyl ether
FL/FR
dimethyl anthranilate
FL/FR
dimethyl benzyl carbinol
FL/FR
floral pyranol
FR
geranyl anthranilate
FR
hawthorn acetate
FR
honeysuckle absolute
FR
hydroxycitronellol
FL/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 sambac
FL/FR
jasmin acetate
FL/FR
jasmin pyranol
FR
para-
jasmone
FR
ortho-
methyl acetophenone
FL/FR
methyl dihydrojasmonate
FL/FR
muguet carboxaldehyde
FR
muguet shiseol
FL/FR
cis-
muguet shiseol
FL/FR
bitter
orangeflower absolute morocco
FL/FR
pentenyl cyclopentanone
FR
petitgrain mandarin oil terpeneless
FL/FR
1-
phenyl propyl butyrate
FL/FR
iso
propyl phenyl acetate
FL/FR
tuberose absolute (from concrete)
FL/FR
tuberose absolute (from pommade)
FL/FR
wallflower absolute
FR
fruity
para-
anisyl methyl ketone
FL/FR
benzyl propionate
FL/FR
berry hexanoate
FR
(E,E)-
ethyl sorbate
FL/FR
heptyl butyrate
FL/FR
styralyl butyrate
FL/FR
green
tiglaldehyde
FL/FR
tiglyl tiglate
FR
herbal
floral nitrile
FR
licorice
(E)-
anethol
FL/FR
musk
musk gx 50% in DEP
FR
musk gx 50% in DPG
FR
musk gx 50% in IPM
FR
spicy
alpha-
amyl cinnamyl alcohol
FL/FR
waxy
decyl acetate
FL/FR
woody
patchouli ethanone
FR
For Flavor
No flavor group found for these
amyl furoate
FL/FR
(E,E)-
digeranyl ether
FL/FR
4-
ethyl anisole
FL
1-
phenyl propyl butyrate
FL/FR
anise
anise
(E)-
anethol
FL/FR
anise oleoresin
FL/FR
anise seed oil
FL/FR
star
anise seed oil china
FL/FR
anise seed oil colombia
FL/FR
star
anise seed oil terpeneless
FL/FR
ethyl para-anisate
FL/FR
sweet
fennel absolute
FL/FR
sweet
fennel oleoresin
FL/FR
anisic
para-
acetanisole
FL/FR
para-
anisyl phenyl acetate
FL/FR
ortho-
methyl acetophenone
FL/FR
citrus
citronellyl oxyacetaldehyde
FL/FR
earthy
alpha-
amyl cinnamyl acetate
FL/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 sambac
FL/FR
jasmin acetate
FL/FR
methyl dihydrojasmonate
FL/FR
cis-
muguet shiseol
FL/FR
muguet shiseol
FL/FR
bitter
orangeflower absolute morocco
FL/FR
tuberose absolute (from concrete)
FL/FR
tuberose absolute (from pommade)
FL/FR
fruity
benzyl acetone
FL/FR
benzyl propionate
FL/FR
dimethyl anthranilate
FL/FR
(E,E)-
ethyl sorbate
FL/FR
petitgrain mandarin oil terpeneless
FL/FR
styralyl butyrate
FL/FR
tiglaldehyde
FL/FR
green
cyclohexyl ethyl alcohol
FL/FR
dihydromyrcenol
FL/FR
heptyl butyrate
FL/FR
2-
phenyl propyl alcohol
FL/FR
herbal
dihydroanethol
FL/FR
ocimum basilicum herb oil
FL/FR
honey
benzyl phenyl acetate
FL/FR
iso
propyl phenyl acetate
FL/FR
licorice
2-
butyl-3-methyl pyrazine
FL
medicinal
dimethyl benzyl carbinol
FL/FR
powdery
ortho-
acetanisole
FL/FR
hydroxycitronellol
FL/FR
powdery ketone
FL
spicy
alpha-
amyl cinnamyl alcohol
FL/FR
para-
anisyl methyl ketone
FL/FR
tarragon
sassafras acetate
FL/FR
waxy
decyl acetate
FL/FR
 
Potential Uses:
FRamber
FRautumn
 calyx
FRincense
FRjasmin
FRorchid
FRpeach
 
Occurrence (nature, food, other):note
 not found in nature
 
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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