isoamyl 3-(2-furan) propionate
isoamyl 3-(2-furan)propionate
 
Notes:
Flavouring ingredient
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      Product(s):
      09-24000 ISOAMYL-2-FURYL PROPIONATE, Kosher
       
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3-methylbutyl 3-(furan-2-yl)propanoate (Click)
CAS Number: 7779-67-1Picture of molecule
ECHA EINECS - REACH Pre-Reg: 231-932-8
FDA UNII: 4B479FVZ19
Nikkaji Web: J184.213G
MDL: MFCD00238526
CoE Number: 2092
XlogP3: 2.70 (est)
Molecular Weight: 210.27306000
Formula: C12 H18 O3
NMR Predictor: Predict (works with chrome or firefox)
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
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
IBM Patents: Obtain
Pubchem Patents: Search
JECFA Food Flavoring: 1515  isoamyl 3-(2-furan)propionate
Flavis Number: 13.023 (Old)
DG SANTE Food Flavourings: 13.023  isoamyl 3-(2-furan)propionate
FEMA Number: 2071  isoamyl 3-(2-furan)propionate
FDA Mainterm: ISOAMYL 3-(2-FURAN)PROPIONATE
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.
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 96.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.98700 to 0.99300 @  25.00 °C.
Pounds per Gallon - (est).: 8.213 to  8.263
Refractive Index: 1.54900 to 1.55700 @  20.00 °C.
Boiling Point: 258.00 °C. @ 760.00 mm Hg
Acid Value: 5.00 max. KOH/g
Vapor Pressure: 0.009000 mm/Hg @ 25.00 °C. (est)
Flash Point: > 230.00 °F. TCC ( > 110.00 °C. )
logP (o/w): 3.361 (est)
Soluble in:
 alcohol
 water, 20.65 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items: note
isobutyl 3-(2-furan) propionate
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Organoleptic Properties:
Odor Type: green
Odor Strength: medium
 sweet  green  floral  fruity  apple green apple  rose  raisin  caramellic  
Odor Description:
at 100.00 %. 
sweet green floral fruity sour apple rose raisin caramel
 green  
Taste Description:
green
  
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Cosmetic Information:
None found
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Suppliers:
Parchem
isoAmyl 3-(2-furan) Propionate
Penta International
ISOAMYL-2-FURYL PROPIONATE, Kosher
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Safety Information:
European information :
Most important hazard(s):
None - None found.
S 02 - Keep out of the reach of children.
S 23 - Do not breath vapour.
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.
 
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: flavor and fragrance agents
Recommendation for isoamyl 3-(2-furan) propionate usage levels up to:
  0.7000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.24 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.09 (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
Click here to view publication 3
 average usual ppmaverage maximum ppm
baked goods: 1.600003.60000
beverages(nonalcoholic): 0.020000.33000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 0.330000.65000
fruit ices: 0.330000.65000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 1.600003.60000
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: --
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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):
Flavouring Group Evaluation 67 (FGE.67): Consideration of 40 furan-substituted aliphatic hydrocarbons, alcohols, aldehydes, ketones, carboxylic acids and related esters, sulfides, disulfides and ethers evaluated by JECFA at the 65th meeting (JECFA, 2006b) and re-evaluated at the 69th meeting (JECFA, 2009c)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 67, Revision 1 (FGE.67Rev.1): Consideration of 40 furan-substituted aliphatic hydrocarbons, alcohols, aldehydes, ketones, carboxylic acids and related esters, sulfides, disulfides and ethers evaluated by JECFA at the 65th meeting (JECFA, 2006b) and re-evaluated at the 69th meeting (JECFA, 2009c)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 67 Revision 2 (FGE.67Rev2): Consideration of 28 furan-substituted compounds evaluated by JECFA at the 55th, 65th and 69th meetings (JECFA, 2001, 2006a, 2009b)
View page or View pdf
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 538506
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 3-methylbutyl 3-(furan-2-yl)propanoate
Chemidplus: 0007779671
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References:
 3-methylbutyl 3-(furan-2-yl)propanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 7779-67-1
Pubchem (cid): 538506
Pubchem (sid): 135262956
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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
HMDB (The Human Metabolome Database): HMDB37735
FooDB: FDB016865
Export Tariff Code: 2932.19.0000
ChemSpider: View
EFSA Update of results on the monitoring of furan levels in food: Read Report
EFSA Previous report: Results on the monitoring of furan levels in food: Read Report
EFSA Report of the CONTAM Panel on provisional findings on furan in food: Read Report
Read: Under the conditions of intended use - New developments in the FEMA GRAS program and the safety assessment of flavor ingredients
Read: A GRAS assessment program for flavor ingredients
Read: Sensory testing for flavorings with modifying properties. Food Technology
Read: Criteria for the safety evaluation of flavoring substances
Read: A procedure for the safety evaluation of natural flavor complexes used as ingredients in food: essential oils
Read: FEMA Expert Panel: 30 Years of safety evaluation for the flavor industry
Read: Consumption ratio and food predominance of flavoring materials
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Potential Blenders and core components note
 
For Odor
No odor group found for these
(E)-tiglaldehydeFL/FR
animal
para-cresyl isobutyrateFL/FR
balsamic
 fir carboxylateFR
citrus
 citral dimethyl acetalFL/FR
(E)-4-decenalFL/FR
ethereal
 ethyl formateFL/FR
fatty
3-decen-2-oneFL/FR
 hexyl pivalateFR
 methyl 2-hexenoateFL/FR
fermented
3-methyl-1-pentanolFL/FR
floral
alpha-amyl cinnamaldehyde diethyl acetalFR
 anisyl propanal / methyl anthranilate schiff's baseFR
 citronellyl acetateFL/FR
 citronellyl propionateFL/FR
 cuminyl acetaldehydeFL/FR
gamma-damasconeFR
 dimethyl benzyl carbinolFL/FR
6,8-dimethyl-2-nonanolFR
 ethyl 2-benzyl butyrateFL/FR
 farnesyl acetateFL/FR
 gardenia absoluteFR
(E)-geranyl acetoneFL/FR
 hydroxycitronellal diethyl acetalFL/FR
 lily propanolFR
 muguet carbinolFL/FR
 ocean propanal / methyl anthranilate schiff's baseFR
 papaya isobutyrateFL/FR
 phenyl acetaldehyde diisobutyl acetalFL/FR
(Z)-rose oxideFL/FR
 styralyl formateFL/FR
 terpinyl isobutyrateFL/FR
fresh
 sorbyl isobutyrateFL/FR
fruity
 acetaldehyde dihexyl acetalFL/FR
 amyl hexanoateFL/FR
 artemisia pallens herb oilFL/FR
 benzyl methyl etherFL/FR
 berry pentadienoateFL/FR
 diethyl malonateFL/FR
 dimethyl benzyl carbinyl isobutyrateFR
 dimethyl succinateFL/FR
 ethyl (E)-2-decenoateFL/FR
 ethyl 2-methyl butyrateFL/FR
 ethyl 3,5,5-trimethyl hexanoateFR
 ethyl acetoacetateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
 fig crotonateFR
 geranyl isovalerateFL/FR
 green acetateFR
 heptyl isobutyrateFL/FR
 hexanal propylene glycol acetalFL/FR
(Z)-3-hexen-1-yl 2-methyl-2-pentenoateFR
 hexyl (E)-tiglateFL/FR
 hexyl acetateFL/FR
 hexyl isovalerateFL/FR
 hexyl propionateFL/FR
 linalyl hexanoateFL/FR
 methyl 2-methyl butyrateFL/FR
 methyl valerateFL/FR
 peach pivalateFR
4-phenyl-2-butyl acetateFL/FR
green
 acetaldehyde benzyl 2-methoxyethyl acetalFL/FR
 acetaldehyde methyl hexyl acetalFR
 butyl 2-methyl butyrateFL/FR
isobutyl benzyl carbinolFL/FR
 chrysanthemum oxideFL/FR
 cognac heptanoneFL/FR
 decanal propylene glycol acetalFL/FR
 earthy acetalFL/FR
 ethyl (E)-2-hexenoateFL/FR
 ethyl (E)-4-decenoateFL/FR
 geranium absoluteFL/FR
 green dioxolaneFR
(Z)-3-hexen-1-yl (E)-2-hexenoateFL/FR
(Z)-3-hexen-1-yl 2-methyl butyrateFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl butyrateFL/FR
(Z)-3-hexen-1-yl hexanoateFL/FR
(Z)-3-hexen-1-yl isovalerateFL/FR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl valerateFL/FR
(E)-2-hexen-1-yl valerateFL/FR
2-hexenyl acetateFL/FR
 hexyl butyrateFL/FR
 hexyl isobutyrateFL/FR
 hyacinth absoluteFL/FR
 ivy carbaldehyde / methyl anthranilate schiff's baseFR
 methyl cyclocitrone (IFF)FR
4-methyl-4-phenyl pentanoneFR
 octyl oxyacetaldehydeFR
(E)-2-pentenalFL/FR
 phenethyl isopropyl etherFR
 phenethyl oxyacetaldehydeFR
 phenethyl tiglateFL/FR
 phenoxyethyl isobutyrateFL/FR
 phenyl acetaldehydeFL/FR
alpha-isopropyl phenyl acetaldehydeFL/FR
 thiogeraniolFL/FR
herbal
 clary sage absoluteFL/FR
 tagete oil indiaFL/FR
 tricyclodecyl acetateFR
marine
 marine hexaneFR
spicy
 cinnamyl isovalerateFL/FR
sulfurous
 buchu mercaptanFL/FR
waxy
9-decenoic acidFL/FR
(E)-methyl geranateFL/FR
woody
 amber carbinolFR
 woody acetateFR
 
For Flavor
 
No flavor group found for these
 acetaldehyde benzyl 2-methoxyethyl acetalFL/FR
 acetaldehyde dihexyl acetalFL/FR
 allyl tiglateFL
 benzyl disulfideFL
 benzyl methyl etherFL/FR
 butyl 2-methyl butyrateFL/FR
 chrysanthemum oxideFL/FR
 decanal propylene glycol acetalFL/FR
 dimethyl benzyl carbinolFL/FR
 earthy acetalFL/FR
 ethyl 2-benzyl butyrateFL/FR
(E,E)-2,4-heptadien-1-olFL
(Z)-3-hexen-1-yl (E)-2-hexenoateFL/FR
2-hexenal diethyl acetalFL
2-hexenyl acetateFL/FR
 hexyl propionateFL/FR
 hyacinth absoluteFL/FR
 linalyl hexanoateFL/FR
 methyl 2-hexenoateFL/FR
 methyl 4-pentenoateFL
(E)-methyl geranateFL/FR
4-phenyl-2-butyl acetateFL/FR
alpha-isopropyl phenyl acetaldehydeFL/FR
 styralyl formateFL/FR
 terpinyl isobutyrateFL/FR
(E)-tiglaldehydeFL/FR
aromatic
para-cresyl isobutyrateFL/FR
balsamic
isobutyl benzyl carbinolFL/FR
berry
 heptyl isobutyrateFL/FR
cinnamon
 sorbyl isobutyrateFL/FR
citrus
 citral dimethyl acetalFL/FR
 cognac heptanoneFL/FR
cucumber
2-ethyl octine carbonateFL
earthy
1-hexen-3-yl acetateFL
estery
 ethyl acetoacetateFL/FR
ethereal
 ethyl formateFL/FR
fatty
3-decen-2-oneFL/FR
 ethyl (E)-4-decenoateFL/FR
floral
 citronellyl acetateFL/FR
 citronellyl propionateFL/FR
 farnesyl acetateFL/FR
(E)-geranyl acetoneFL/FR
 muguet carbinolFL/FR
 papaya isobutyrateFL/FR
fruity
 amyl hexanoateFL/FR
 artemisia pallens herb oilFL/FR
 berry pentadienoateFL/FR
 cinnamyl isovalerateFL/FR
 diethyl malonateFL/FR
 dimethyl succinateFL/FR
 ethyl (E)-2-decenoateFL/FR
 ethyl (E)-2-hexenoateFL/FR
 ethyl 2-methyl butyrateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
 hexanal propylene glycol acetalFL/FR
(E)-2-hexenal diethyl acetalFL
 hexyl acetateFL/FR
 methyl 2-methyl butyrateFL/FR
 methyl valerateFL/FR
green
 clary sage absoluteFL/FR
 cuminyl acetaldehydeFL/FR
 geranium absoluteFL/FR
 geranyl isovalerateFL/FR
(Z)-3-hexen-1-yl 2-methyl butyrateFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl butyrateFL/FR
(Z)-3-hexen-1-yl hexanoateFL/FR
(Z)-3-hexen-1-yl isovalerateFL/FR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl valerateFL/FR
(E)-2-hexen-1-yl valerateFL/FR
 hexyl (E)-tiglateFL/FR
 hexyl butyrateFL/FR
 hexyl isobutyrateFL/FR
 hexyl isovalerateFL/FR
 methyl 2-undecynoateFL
4-methyl-2-pentenalFL
(E)-2-pentenalFL/FR
 phenoxyethyl isobutyrateFL/FR
(Z)-rose oxideFL/FR
herbal
 tagete oil indiaFL/FR
honey
 phenyl acetaldehydeFL/FR
 phenyl acetaldehyde diisobutyl acetalFL/FR
melon
 hydroxycitronellal diethyl acetalFL/FR
minty
 thiogeraniolFL/FR
ripe
(E)-4-decenalFL/FR
sour
3-methyl valeric acidFL
sulfurous
 buchu mercaptanFL/FR
sweet
 phenethyl tiglateFL/FR
waxy
9-decenoic acidFL/FR
whiskey
3-methyl-1-pentanolFL/FR
 
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Potential Uses:
 caramelFL
 floralFR
 greenFR
 raisinFR
 whiskey 
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
isoamyl 2-furan propionate so called
isoamyl 2-furyl propionate
isoamyl 3-(2-furan)-propionate
isoamyl 3-(2-furan)propionate
alpha-isoamyl furfuryl acetate
N-amyl furyl acrylate
iso-amyl furylpropionate
 fruity acrylate
2-furanpropanoic acid, 3-methylbutyl ester
3-methyl butyl 2-furyl propionate
3-methyl butyl 3-(furan-2-yl)propanoate
3-methyl butyl furan-2-propionate
3-methylbutyl 2-furylpropionate
3-methylbutyl 3-(2-furyl)propionate
3-methylbutyl 3-(furan-2-yl)propanoate
3-methylbutyl furan-2-propionate
isopentyl 2-furan propionate
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