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ethyl isoeugenol
isoeugenyl ethyl ether

Sponsors

Name:1-ethoxy-2-methoxy-4-[(E)-prop-1-enyl]benzene
CAS Number: 7784-67-0Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:232-072-6
FDA UNII:ZDR23DW95V
Nikkaji Web:J179.195H
MDL:MFCD00038710
CoE Number:190
XlogP3:3.20 (est)
Molecular Weight:192.25792000
Formula:C12 H16 O2
BioActivity Summary:listing
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
CASrn in Register does not specify stereoisomers. Mixture of E/Z-isomers (EFFA, 2010a). Composition of stereoisomeric mixture to be specified.
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
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Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
JECFA Food Flavoring:1267 isoeugenyl ethyl ether
FLAVIS Number:04.017 (Old)
DG SANTE Food Flavourings:04.017 1-ethoxy-2-methoxy-4-(prop-1-enyl)benzene
FEMA Number:2472 isoeugenyl ethyl ether
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm: ISOEUGENYL ETHYL ETHER
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 crystals (est)
Assay: 96.00 to 100.00
Food Chemicals Codex Listed: No
Melting Point: 63.00 to 64.00 °C. @ 760.00 mm Hg
Boiling Point: 245.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.004000 mm/Hg @ 25.00 °C. (est)
Flash Point: 229.00 °F. TCC ( 109.44 °C. )
logP (o/w): 3.558 (est)
Soluble in:
 acetic acid
 alcohol
 ether
 water, 54.88 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: spicy
Odor Strength:medium
spicy carnation clove
Odor Description:at 100.00 %. spicy carnation clove
Flavor Type: spicy
">spicy clove
Taste Description: spicy clove
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Benzene,1-ethoxy-2-methoxy-4-(1-propen-1-yl)-
Sigma-Aldrich: Aldrich
For experimental / research use only.
isoeugenyl ethyl ether
Synerzine
isoEugenyl Ethyl Ether
 
Safety Information:
Preferred SDS: View
 
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: flavor and fragrance agents
Recommendation for ethyl isoeugenol usage levels up to:
  2.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.12 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.009 (μg/capita/day)
Structure Class: III
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: 1.000003.50000
beverages(nonalcoholic): -7.80000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -0.50000
fruit ices: -0.50000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -17.00000
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):

Scientific Opinion on Flavouring Group Evaluation 81 (FGE.81): Consideration of hydroxypropenylbenzenes evaluated by JECFA (61st meeting) structurally related to 2-methoxy-4-(prop-1-enyl)phenyl 3-methylbutyrate from chemical group 17 evaluated by EFSA in FGE.30
View page or View pdf

EPI System: View
EPA Substance Registry Services (TSCA):7784-67-0
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5382490
National Institute of Allergy and Infectious Diseases:Data
1-ethoxy-2-methoxy-4-[(E)-prop-1-enyl]benzene
Chemidplus:0007784670
 
References:
 1-ethoxy-2-methoxy-4-[(E)-prop-1-enyl]benzene
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:7784-67-0
Pubchem (cid):5382490
Pubchem (sid):135263079
 
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):Search
ChemSpider:View
 
Potential Blenders and core components note
For Odor
No odor group found for these
iso
eugenyl benzoate
FR
iso
eugenyl butyl ether
FL/FR
balsamic
balsamic
clover nitrile
FR
earthy
octyl phenyl acetate
FL/FR
floral
amyl salicylate
FL/FR
bois de rose oil brazil
FL/FR
iso
butyl salicylate
FL/FR
butyl salicylate
FL/FR
cardamom absolute
FL/FR
cassie absolute
FL/FR
cestrum nocturnum flower absolute
FR
cestrum nocturnum flower oil
FR
champaca absolute
FR
coranol (Firmenich)
FR
dihydrolinalool
FL/FR
3,6-
dimethyl-3-octanol
FL/FR
ethyl linalool
FR
ethyl linalyl acetal
FR
ethyl linalyl acetate
FR
ethyl linalyl ether
FL/FR
iso
eugenyl ethyl acetal
FR
heliotropyl diethyl acetal
FR
ho leaf oil
FR
ho wood oil
FR
(Z)-
jasmone
FL/FR
dextro-
linalool
FL/FR
linalool
FL/FR
laevo-
linalool
FL/FR
linalool oxide
FL/FR
linalyl anthranilate
FL/FR
phenethyl salicylate
FL/FR
phenyl amyl alcohol
FL/FR
propyl salicylate
FR
tetrahydrolinalool
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
phenyl acetaldehyde
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
eugenyl formate
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
amyl isoeugenol
FR
homo
anisaldehyde
FL/FR
benzyl isoeugenol
FL/FR
calamus leaf oil
FR
cananga leaf oil
FR
canella bark oil
FR
4-
carvomenthenol
FL/FR
beta-
caryophyllene
FL/FR
caryophyllene
FL/FR
cinnamomum culilawan bark oil
FR
cinnamomum culilawan leaf oil
FR
cinnamon leaf oil ceylon
FL/FR
cinnamon leaf oil replacer
FR
cinnamyl acetate
FL/FR
clove bud absolute
FL/FR
clove bud oil
FL/FR
clove bud oleoresin
FL/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
cubeb oil
FL/FR
iso
cyclogeraniol (IFF)
FR
dianthus ethone
FR
dihydroeugenol
FL/FR
4-
ethyl guaiacol
FL/FR
iso
eugenol
FL/FR
eugenol
FL/FR
(E)-iso
eugenol
FR
iso
eugenyl acetate
FL/FR
eugenyl acetate
FL/FR
eugenyl benzoate
FL/FR
eugenyl isovalerate
FL/FR
eugenyl phenyl acetate
FL/FR
iso
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
pimenta acris leaf oil
FL/FR
pimenta officinalis fruit extract
FR
vanilla
methyl vanillate
FL/FR
woody
cedrela wood oil
FR
2-
methoxy-4-vinyl phenol
FL/FR
rhubarb oxirane
FR
For Flavor
No flavor group found for these
homo
anisaldehyde
FL/FR
butyl salicylate
FL/FR
ethyl linalyl ether
FL/FR
O-
ethyl S-(2-furyl methyl) thiocarbonate
FL
ortho-
eugenol
FL
eugenyl benzoate
FL/FR
iso
eugenyl butyl ether
FL/FR
eugenyl formate
FL/FR
iso
eugenyl formate
FL/FR
eugenyl isovalerate
FL/FR
eugenyl phenyl acetate
FL/FR
jasmin carnation fragrance
FL
laurus nobilis leaf oil turkey
FL/FR
dextro-
linalool
FL/FR
(E)-para-
methoxycinnamaldehyde
FL/FR
methyl furfuracrylate
FL
methyl vanillate
FL/FR
(±)-3-((2-
methyl-3-furyl)thio)-2-butanone
FL
octyl phenyl acetate
FL/FR
phenyl amyl alcohol
FL/FR
sodium ferulate
FL
aromatic
aromatic
amyl salicylate
FL/FR
citrus
laevo-
linalool
FL/FR
linalool
FL/FR
cooling
iso
butyl salicylate
FL/FR
4-
carvomenthenol
FL/FR
homo
menthyl acetate
FL/FR
floral
bois de rose oil brazil
FL/FR
cardamom absolute
FL/FR
dihydrolinalool
FL/FR
linalyl anthranilate
FL/FR
tetrahydrolinalool
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
clary sage absolute
FL/FR
(E,E)-2,4-
hexadienal
FL
linalool oxide
FL/FR
herbal
3,6-
dimethyl-3-octanol
FL/FR
honey
phenyl acetaldehyde
FL/FR
medicinal,
phenethyl salicylate
FL/FR
smoky
2-
methoxy-4-vinyl phenol
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
caryophyllene
FL/FR
beta-
caryophyllene
FL/FR
cassie absolute
FL/FR
cinnamon leaf oil ceylon
FL/FR
cinnamyl acetate
FL/FR
clove bud absolute
FL/FR
clove bud oil
FL/FR
clove bud oleoresin
FL/FR
clove leaf oil
FL/FR
clove leaf oil terpeneless
FL/FR
clove stem oil
FL/FR
cubeb oil
FL/FR
dihydroeugenol
FL/FR
iso
eugenol
FL/FR
eugenol
FL/FR
iso
eugenyl acetate
FL/FR
eugenyl acetate
FL/FR
iso
eugenyl phenyl acetate
FL/FR
4-
methyl biphenyl
FL
methyl isoeugenol
FL/FR
pimenta acris leaf oil
FL/FR
vanilla
4-
methyl guaiacol
FL/FR
woody
4-
ethyl guaiacol
FL/FR
(Z)-
jasmone
FL/FR
 
Potential Uses:
FRbalsam
FRcassia
FRcinnamon
FRclove
FRdavana oil replacer
FRoriental
FRspice
FRtonka bean
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benzene, 1-ethoxy-2-methoxy-4- (1-propenyl)-
 benzene, 1-ethoxy-2-methoxy-4-[(1E)-1-propen-1-yl]-
 benzene, 1-ethoxy-2-methoxy-4-propenyl-
1-ethoxy-2-methoxy-4-(1-propenyl) benzene
1-ethoxy-2-methoxy-4-(prop-1-enyl)benzene
1-ethoxy-2-methoxy-4-[(1E)-prop-1-en-1-yl]benzene
1-ethoxy-2-methoxy-4-[(E)-prop-1-enyl]benzene
1-ethoxy-2-methoxy-4-propen-1-yl benzene
1-ethoxy-2-methoxy-4-propenyl benzene
2-ethoxy-5-propenyl anisole
2-ethoxy-5-propenylanisole
isoeugenyl ethyl ether
iso-eugenyl ethyl ether
2-methoxy-4-prop-1-enyl phenetole
 
 
Notes:
None found
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