geranyl acetoacetate
trans-3,7-dimethyl-2,6-octadien-1-yl 3-oxobutanoate
 
Notes:
None found
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      Product(s):
      10032-00-5 Geranyl Acetoacetate
       
  • Penta International
    • Penta International Corporation
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      Product(s):
      07-11500 GERANYL ACETOACETATE
       
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CAS Number: 10032-00-5Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 233-101-5
FDA UNII: 08QN2PN8MT
Nikkaji Web: J54.985A
CoE Number: 243
XlogP3-AA: 3.30 (est)
Molecular Weight: 238.32694000
Formula: C14 H22 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
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Perfumer and Flavorist: Search
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US Patents: Search
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Pubchem Patents: Search
PubMed: Search
NCBI: Search
JECFA Food Flavoring: 599  geranyl acetoacetate
DG SANTE Food Flavourings: 09.405  geranyl acetoacetate
FEMA Number: 2510 geranyl acetoacetate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):10032-00-5 ; GERANYL ACETOACETATE
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 oily liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 127.00 to  129.00 °C. @ 22.00 mm Hg
Vapor Pressure: 0.000115 mmHg @ 25.00 °C. (est)
Flash Point: 291.00 °F. TCC ( 143.89 °C. )
logP (o/w): 3.517 (est)
Soluble in:
 alcohol
 oils
 water, 33.71 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items: note
amyl acetoacetate
isoamyl acetoacetate
para-anisyl acetoacetate
benzyl acetoacetate
bergamot acetoacetate
butyl acetoacetate
isobutyl acetoacetate
cinnamyl acetoacetate
cyclohexyl acetoacetate
dodecyl acetoacetate
ethyl 2-ethyl acetoacetate
ethyl acetoacetate
heptyl acetoacetate
(Z)-3-hexen-1-yl acetoacetate
hexyl acetoacetate
jasmin acetoacetate
laevo-menthyl acetoacetate
methyl acetoacetate
spicy acetoacetate
Synonyms   Articles   Notes   Search   Top
Organoleptic Properties:
 
Odor Type: fruity
 
 sweet  fruity  winey  fermented  apple skin  
Odor Description:
at 100.00 %. 
sweet fruity winey fermented apple skin
 
Odor and/or flavor descriptions from others (if found).
 
 
Synonyms   Articles   Notes   Search   Top
Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
Synonyms   Articles   Notes   Search   Top
Suppliers:
BOC Sciences
For experimental / research use only.
Geranyl Acetoacetate
Nagar Haveli Perfumes & Aromatics
Geranyl Acetoacetate
Odor: Sweet fruity winey fermented apple skin
Penta International
GERANYL ACETOACETATE
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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.
Human Experience:
4 % solution: no irritation or sensitization.
Oral/Parenteral Toxicity:
oral-rat LD50  > 5000 mg/kg
(Moreno, 1976k)

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
Synonyms   Articles   Notes   Search   Top
Safety in Use Information:
Category: flavor and 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 geranyl acetoacetate usage levels up to:
  6.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): ND (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 0.04 (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
Click here to view publication 3
 average usual ppmaverage maximum ppm
baked goods: 1.0000010.00000
beverages(nonalcoholic): 0.500000.50000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 1.000001.00000
fruit ices: 1.000001.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 1.000003.00000
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: --
Synonyms   Articles   Notes   Search   Top
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):
Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission related to - Flavouring Group Evaluation 10: Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf
Flavouring Group Evaluation 10, Revision 1 (FGE10 Rev1)[1] - Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food (AFC)
View page or View pdf
Flavouring Group Evaluation 202: 3-Alkylated aliphatic acyclic alpha,beta-unsaturated aldehydes and precursors with or without additional double bonds from chemical subgroup 1.1.3 of FGE.19[1]
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 10, Revision 2 (FGE.10Rev2): Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 5956805
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 2
 [(2E)-3,7-dimethylocta-2,6-dienyl] 3-oxobutanoate
Chemidplus: 0010032005
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References:
 [(2E)-3,7-dimethylocta-2,6-dienyl] 3-oxobutanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 10032-00-5
Pubchem (cid): 5956805
Pubchem (sid): 134990482
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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
FDA Substances Added to Food (formerly EAFUS): View
CHEBI: View
HMDB (The Human Metabolome Database): HMDB38256
FooDB: FDB017550
Export Tariff Code: 2915.39.9050
ChemSpider: View
FAO: Geranyl acetoacetate
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
alcoholic
alcoholic
 fusel oilFL/FR
 propyl alcoholFL/FR
balsamic
 cinnamyl butyrateFL/FR
 opoponax oil (balsamodendron kafal)FL/FR
 opoponax resinoid (balsamodendron kafal)FR
 terpinyl cinnamateFL/FR
berry
 methyl furoate 
caramellic
 diethyl malateFL/FR
earthy
 amyl octanoateFL/FR
 octyl phenyl acetateFL/FR
ethereal
isoamyl acetoacetateFL/FR
isobutyl alcoholFL/FR
 methyl acetateFL/FR
2-methyl-1-butanolFL/FR
fatty
 butyl undecylenateFL/FR
3-decen-2-oneFL/FR
fermented
 butyl laevo-lactateFL/FR
 methyl decanoateFL/FR
3-methyl-1-pentanolFL/FR
2-pentanolFL/FR
 valeraldehydeFL/FR
floral
 bois de rose oil brazilFL/FR
 coranol (Firmenich)FR
alpha-damasconeFL/FR
gamma-damasconeFR
 dihydrolinaloolFL/FR
 dimethyl anthranilateFL/FR
3,6-dimethyl-3-octanolFL/FR
 ethyl linaloolFR
 ethyl linalyl acetalFR
 ethyl linalyl acetateFR
 ethyl linalyl etherFL/FR
 ho leaf oilFR
 ho wood oilFR
laevo-linaloolFL/FR
dextro-linaloolFL/FR
 linaloolFL/FR
 linalool oxideFL/FR
 linalyl anthranilateFL/FR
 methyl citronellateFL/FR
 rose oil (rosa damascena) bulgariaFL/FR
 tetrahydrolinaloolFL/FR
fruity
 acetaldehyde diisoamyl acetalFL/FR
 amyl 2-methyl butyrateFL/FR
 amyl isobutyrateFL/FR
 amyl isovalerateFL/FR
isoamyl valerateFL/FR
 apple ketalFL/FR
 benzyl ethyl malonate 
 benzyl isovalerateFL/FR
 benzyl propionateFL/FR
isobutyl acetoacetateFL/FR
 butyl acetoacetateFL/FR
 butyl anthranilateFL/FR
 butyl hexanoateFL/FR
 butyl isovalerateFL/FR
isobutyl isovalerateFL/FR
1-isobutyl-2-methyl butyl 2-butenoate 
 cyclohexyl butyrateFL/FR
 cyclohexyl isovalerateFL/FR
 diethyl laevo-tartrateFL/FR
 diethyl sebacateFL/FR
1,2-dimethyl propyl 2-butenoate 
 dodecyl propionateFL/FR
 ethyl 2-ethyl acetoacetateFL/FR
 ethyl 3,5,5-trimethyl hexanoateFR
 ethyl heptanoateFL/FR
 ethyl isovalerateFL/FR
 ethyl valerateFL/FR
 farnesyl acetoneFL/FR
 fruity ketalFL/FR
 geranyl 2-methyl butyrateFL/FR
 geranyl isovalerateFL/FR
 grape butyrateFL/FR
(Z)-3-hexen-1-yl isobutyrateFL/FR
(Z)-3-hexenal dimethyl acetal 
 hexyl formateFL/FR
 methyl butyrateFL/FR
 methyl isovalerateFL/FR
 methyl nonanoateFL/FR
 methyl valerateFL/FR
 nonyl isovalerateFL/FR
2-pentanoneFL/FR
 propyl 2-methyl butyrateFL/FR
 propyl angelate 
 propyl heptanoateFL/FR
 propyl isovalerateFL/FR
isopropyl isovalerateFL/FR
 sorbyl butyrateFL/FR
green
 benzaldehyde dimethyl acetalFL/FR
 butyl heptanoateFL/FR
 butyl lactateFL/FR
green cognac oilFL/FR
 heptanal (aldehyde C-7)FL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl butyrateFL/FR
(E)-2-hexen-1-yl butyrateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(E)-2-hexen-1-yl valerateFL/FR
(Z)-3-hexen-1-yl valerateFL/FR
(Z)-3-hexenal diethyl acetalFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl butyrateFL/FR
 hexyl isobutyrateFL/FR
 hexyl phenyl acetateFL/FR
 manzanate (Givaudan)FL/FR
(E)-2-pentenalFL/FR
herbal
isoamyl tiglateFL/FR
 clary sage concreteFL/FR
white cognac oilFL/FR
 ethyl chrysanthemateFR
 phenethyl senecioateFL/FR
honey
 methyl hydrocinnamateFL/FR
oily
(R)-(-)-2-butanol 
 cubeb oilFL/FR
waxy
 allyl nonanoateFL/FR
isoamyl laurateFL/FR
 ethyl decanoateFL/FR
 ethyl nonanoateFL/FR
 ethyl octanoateFL/FR
winey
 butyl angelateFL/FR
2-hexanolFL/FR
 methyl 3-acetoxyoctanoateFL/FR
woody
 kaempferia galanga rhizome oilFL/FR
 marine formateFR
 
For Flavor
 
No flavor group found for these
 acetaldehyde diisoamyl acetalFL/FR
 amyl 2-methyl butyrateFL/FR
 amyl isobutyrateFL/FR
 amyl isovalerateFL/FR
 amyl octanoateFL/FR
isoamyl tiglateFL/FR
2-amyl-5 or 6-keto-1,4-dioxaneFL
 benzyl ethyl malonate 
(R)-(-)-2-butanol 
 butyl acetoacetateFL/FR
 butyl angelateFL/FR
2-butyl furanFL
1-isobutyl-2-methyl butyl 2-butenoate 
isobutyraldehyde propylene glycol acetalFL
 cyclohexyl butyrateFL/FR
 diethyl laevo-tartrateFL/FR
 diethyl malateFL/FR
1,2-dimethyl propyl 2-butenoate 
 dodecyl propionateFL/FR
 ethyl 3-hydroxyoctanoateFL
 ethyl aconitateFL
 ethyl linalyl etherFL/FR
 farnesyl acetoneFL/FR
 geranyl 2-methyl butyrateFL/FR
 heptyl 2-methyl butyrateFL
2-hexanolFL/FR
(Z)-3-hexenal diethyl acetalFL/FR
(E)-2-hexenal dimethyl acetalFL
(Z)-3-hexenal dimethyl acetal 
dextro-linaloolFL/FR
 methyl 3-acetoxyoctanoateFL/FR
 methyl furoate 
 methyl hydrocinnamateFL/FR
 nonyl isovalerateFL/FR
 octyl phenyl acetateFL/FR
 oenanthic etherFL
 phenethyl senecioateFL/FR
 propyl 2-methyl butyrateFL/FR
 propyl angelate 
 propyl isovalerateFL/FR
isopropyl isovalerateFL/FR
 sorbyl propionateFL
alcoholic
 propyl alcoholFL/FR
balsamic
 opoponax oil (balsamodendron kafal)FL/FR
buttery
 butyl laevo-lactateFL/FR
camphoreous
 kaempferia galanga rhizome oilFL/FR
citrus
laevo-linaloolFL/FR
 linaloolFL/FR
coffee
 diisoamyl thiomalateFL
cooling
 manzanate (Givaudan)FL/FR
ethereal
isobutyl alcoholFL/FR
 methyl acetateFL/FR
2-methyl-1-butanolFL/FR
fatty
isoamyl laurateFL/FR
 methyl decanoateFL/FR
fermented
 methyl thio isovalerateFL
floral
 bois de rose oil brazilFL/FR
 dihydrolinaloolFL/FR
 linalyl anthranilateFL/FR
 methyl citronellateFL/FR
 rose oil (rosa damascena) bulgariaFL/FR
 tetrahydrolinaloolFL/FR
fruity
isoamyl acetoacetateFL/FR
isoamyl valerateFL/FR
 apple ketalFL/FR
 benzyl isovalerateFL/FR
 benzyl propionateFL/FR
isobutyl acetoacetateFL/FR
 butyl anthranilateFL/FR
 butyl heptanoateFL/FR
 butyl hexanoateFL/FR
 butyl isovalerateFL/FR
 cyclohexyl isovalerateFL/FR
alpha-damasconeFL/FR
 diethyl sebacateFL/FR
 dimethyl anthranilateFL/FR
 ethyl 2-ethyl acetoacetateFL/FR
 ethyl heptanoateFL/FR
 ethyl isovalerateFL/FR
 ethyl valerateFL/FR
 fruity ketalFL/FR
 fusel oilFL/FR
(Z)-3-hexen-1-yl isobutyrateFL/FR
 hexyl phenyl acetateFL/FR
 methyl isovalerateFL/FR
 methyl valerateFL/FR
2-pentanoneFL/FR
 sorbyl butyrateFL/FR
 terpinyl cinnamateFL/FR
fusel
green cognac oilFL/FR
white cognac oilFL/FR
 methyl butyrateFL/FR
green
 benzaldehyde dimethyl acetalFL/FR
isobutyl isovalerateFL/FR
 butyl lactateFL/FR
3-decen-2-oneFL/FR
 geranyl isovalerateFL/FR
 grape butyrateFL/FR
 heptanal (aldehyde C-7)FL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl butyrateFL/FR
(E)-2-hexen-1-yl butyrateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl valerateFL/FR
(E)-2-hexen-1-yl valerateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl butyrateFL/FR
 hexyl formateFL/FR
 hexyl isobutyrateFL/FR
 linalool oxideFL/FR
(E)-2-pentenalFL/FR
herbal
 clary sage concreteFL/FR
3,6-dimethyl-3-octanolFL/FR
musty
2-pentanolFL/FR
 propionaldehydeFL
spicy
 cubeb oilFL/FR
waxy
 allyl nonanoateFL/FR
 butyl undecylenateFL/FR
 ethyl decanoateFL/FR
 ethyl nonanoateFL/FR
 ethyl octanoateFL/FR
 propyl heptanoateFL/FR
whiskey
3-methyl-1-pentanolFL/FR
winey
 cinnamyl butyrateFL/FR
 methyl nonanoateFL/FR
 valeraldehydeFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 appleFR
 blueberryFR
 cherryFR
 floralFR
 fruitFR
 herbalFR
 mangoFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
 acetoacetic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-
 butanoic acid, 3-oxo-, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
 butanoic acid, 3-oxo-, 3,7-dimethyl-2,6-octadienyl ester, (E)-
(E)-3,7-dimethyl-2,6-octadien-1-yl 3-oxobutanoate
trans-3,7-dimethyl-2,6-octadien-1-yl 3-oxobutanoate
3,7-dimethyl-2,6-octadien-1-yl 3-oxobutanoate, trans-
(E)-3,7-dimethyl-2,6-octadien-1-yl acetoacetate
trans-3,7-dimethyl-2,6-octadien-1-yl acetoacetate
3,7-dimethyl-2,6-octadien-1-yl acetoacetate, trans-
3,7-dimethyl-2,6-octadienyl 3-oxobutanoate, (E)-
(E)-3,7-dimethyl-2,6-octadienyl acetoacetate
3,7-dimethyl-2,6-octadienyl acetoacetate, (E)-
(2E)-3,7-dimethylocta-2,6-dien-1-yl 3-oxobutanoate
[(2E)-3,7-dimethylocta-2,6-dienyl] 3-oxobutanoate
(E)-geranyl 3-oxobutanoate
 geranyl acetoacetate
(E)-geranyl beta-ketobutyrate
(E)-neryl acetoacetate
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Synonyms   Articles   Notes   Search   Top
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