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

powdery ketone
ethone

Sponsors

Flavor Demo Formulas
Name:1-(4-methoxyphenyl)pent-1-en-3-one
CAS Number: 104-27-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:203-190-5
Beilstein Number:3197137
CoE Number:164
XlogP3-AA:2.50 (est)
Molecular Weight:190.24198000
Formula:C12 H14 O2
NMR Predictor:Predict (works with chrome or firefox)
Name:(E)-1-(4-methoxyphenyl)pent-1-en-3-one
CAS Number: 82297-64-1Picture of molecule3D/inchi
FDA UNII:U0ZZO1ACOR
Nikkaji Web:J781.562J
XlogP3-AA:2.50 (est)
Molecular Weight:190.24198000
Formula:C12 H14 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:flavoring 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
JECFA Food Flavoring:826 1-(p-methoxyphenyl)-1-penten-3-one
FLAVIS Number:07.030 (Old)
DG SANTE Food Flavourings:07.030 1-(4-methoxyphenyl)pent-1-en-3-one
FEMA Number:2673 1-(p-methoxyphenyl)-1-penten-3-one
FDA Mainterm: 1-(P-METHOXYPHENYL)-1-PENTEN-3-ONE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
 
Physical Properties:
Appearance:white to pale yellow crystalline powder (est)
Assay: 98.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 60.00 °C. @ 760.00 mm Hg
Boiling Point: 278.00 °C. @ 760.00 mm Hg
Boiling Point: 74.00 °C. @ 10.00 mm Hg
Vapor Pressure:0.000139 mm/Hg @ 25.00 °C. (est)
Flash Point: 304.00 °F. TCC ( 151.11 °C. )
logP (o/w): 2.658 (est)
Soluble in:
 alcohol
 water, 289.6 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: powdery
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
dry sweet powdery cherry fruity heliotrope almond anisic vanilla
Odor Description:at 10.00 % in dipropylene glycol. dry sweet powdery cherry fruity heliotrope almond anisic vanilla
Luebke, William tgsc, (2009)
Odor sample from: Apiscent Labs, LLC
sweet powdery cherry vanilla coumarinic heliotrope
Odor Description:Sweet, powdery, cherry, vanilla, coumarin, heliotropine
Mosciano, Gerard P&F 23, No. 5, 49, (1998)
Flavor Type: powdery
sweet powdery vanilla fruity creamy
Taste Description: Sweet, powdery, vanilla, fruity, creamy
Mosciano, Gerard P&F 23, No. 5, 49, (1998)
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
CosIng:cosmetic data
Cosmetic Uses: not used anymore
 
Suppliers:
Apiscent Labs
ETHONE 1-(P-METHOXYPHENYL)-1-PENTEN-3-ONE
Odor: Odor similar to butter, sweet and lasting
BOC Sciences
For experimental / research use only.
1-(4-Methoxyphenyl)-1-penten-3-one
FCI SAS
1-(P-METHOXYPHENYL)-1-PENTEN-3-ONE
Odor: Odor similar to butter, sweet and lasting
Flavor: Sweet, fruity taste at low levels
Jiangyin Healthway
1-(p-methoxyphenyl)-1-pentene-3-one (Ethone)
New functional food ingredients
Kun Shan P&A
Ethone
M&U International
ETHONE, Kosher
Penta International
ETHONE FCC, Kosher
Sunaux International
Ethone
Synerzine
1-(p-Methoxy Phenyl)-1-penten-3-one
Vigon International
Ethone FCC
Odor: SHARP, DRY, SLIGHTLY BUTTERY
 
Safety Information:
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 37/39 - Wear suitable gloves and eye/face protection.
 
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.
Human Experience:
8 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 863, 1979.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Cosmetics Toxicology. Vol. 17, Pg. 863, 1979.

Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category: flavoring agents
IFRA Critical Effect: Sensitization
IFRA: View Standard
Recommendation for powdery ketone usage levels up to:
 PROHIBITED: Should not be used as a fragrance ingredient.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.37 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 110.00 (μg/capita/day)
Structure Class: I
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 3
 average usual ppmaverage maximum ppm
baked goods: -12.00000
beverages(nonalcoholic): -2.30000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -2.30000
fruit ices: -2.30000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -28.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
 
Safety References:
European Food Safety Athority(efsa):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
European Food Safety Authority (EFSA) reference(s):
List of apha, beta-Unsaturated Aldehydes and Ketones representative of FGE.19 substances for Genotoxicity Testing [1] - Statement of the Panel on Food Contact Materials, Enzymes, Flavourings and Processing Aids (CEF)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 215 (FGE.215): Seven a,-Unsaturated Cinnamyl Ketones from subgroup 3.2 of FGE.19
View page or View pdf
EPI System: View
Env. Mutagen Info. Center:Search
EPA Substance Registry Services (TSCA):104-27-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :61008
National Institute of Allergy and Infectious Diseases:Data
SCCNFP:opinion
WGK Germany:2
1-(4-methoxyphenyl)pent-1-en-3-one
Chemidplus:0000104278
(E)-1-(4-methoxyphenyl)pent-1-en-3-one
Chemidplus:0082297641
 
References:
 1-(4-methoxyphenyl)pent-1-en-3-one
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:104-27-8
Pubchem (cid):61008
Pubchem (sid):135018154
 (E)-1-(4-methoxyphenyl)pent-1-en-3-one
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:82297-64-1
Pubchem (cid):5803450
Pubchem (sid):197231
 
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
FDA Everything Added to Food in the United States (EAFUS):View
CHEMBL:View
HMDB (The Human Metabolome Database):HMDB30905
FooDB:FDB002870
ChemSpider:View
Wikipedia:View
RSC Learn Chemistry:View
 
Potential Blenders and core components note
For Odor
amber
cistus ladaniferus resinoid
FR
animal
animal carbolactone
FR
costus valerolactone
FR
anisic
para-
anisyl propanal
FR
balsamic
clover nitrile
FR
fir balsam absolute
FR
floral
anise indene
FR
anisyl propanal / methyl anthranilate schiff's base
FR
autumn carboxylate
FR
para-
cresyl propionaldehyde
CS
dimethyl alpha-ionone
FR
floral pyranol
FR
hawthorn acetate
FR
heliotrope absolute
FR
heliotropyl diethyl acetal
FR
hyacinth ether
FR
orris pyridine 25% IPM
FR
peony alcohol
FR
(E)-2,5,9-
trimethyl-4,9-decadien-1-al
FR
fruity
allyl benzoate
FR
berry hexanoate
FR
peach pivalate
FR
hay
hay absolute
FR
herbal
floral nitrile
FR
melon
watermelon ketone
FR
minty
bitter
fennel seed oil lithuania
CS
mossy
veramoss (IFF)
FR
musk
cyclohexadecanone
FR
exaltone (Firmenich)
FR
musk amberol
FR
musk indane
FR
musk tetralin
FR
spicy
amyl isoeugenol
FR
tonka
coumarin
FR
deertongue absolute
FR
tonka bean absolute
FR
woody
amber formate
FR
anthocephalus cadamba oil
FR
gurjun balsam oil
FR
patchouli ethanone
FR
santall
FR
timber propanol
FR
tobacarol (IFF)
FR
woody acetate
FR
woody epoxide
FR
woody propanol
FR
For Flavor
No flavor group found for these
ethyl 2-phenyl-3-furoate
FL
4-
ethyl anisole
FL
5-
ethyl-2-thiophene carboxaldehyde
FL
methyl furfuracrylate
FL
caramellic
caramellic
caramel furanone
FL
coconut
6-
methyl coumarin
FL
fruity
acetyl isovaleryl
FL
licorice
2-
butyl-3-methyl pyrazine
FL
meaty
ortho-
thioguaiacol
FL
ortho-
thioguaiacol
FL
nutty
furfural acetone
FL
 
Potential Uses:
FLalmond
FLberry mixed
FLbutter
FLbutterscotch
FLcherry
FLcream
FLmaple
FLvanilla
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 ethone
 ethone 1-(p-methoxyphenyl)-1-penten-3-one
 ethone FCC
1-(p-methoxy phenyl)-1-penten-3-one
1-(4-methoxyphenyl) pent-1-en-3-one
1-(4-methoxyphenyl)-1-penten-3-one
1-(p-methoxyphenyl)-1-penten-3-one
1-(para-methoxyphenyl)-1-penten-3-one
1-(4-methoxyphenyl)pent-1-en-3-one
p-methoxystyryl ethyl ketone
para-methoxystyryl ethyl ketone
a-methyl anisylidene acetone
alpha-methyl anisylidene acetone
1-penten-3-one, 1- (4-methoxyphenyl)-
1-penten-3-one, 1- (p-methoxyphenyl)-
1-penten-3-one, 1-(4-methoxyphenyl)-
 powdery ketone
 

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Notes:
Flavouring ingredient
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