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geranyl valerate
[(2E)-3,7-dimethylocta-2,6-dienyl] pentanoate

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Flavor Demo Formulas
Name:[(2E)-3,7-dimethylocta-2,6-dienyl] pentanoate
CAS Number: 10402-47-8Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:233-869-1
FDA UNII:317HUA93QY
Nikkaji Web:J184.196C
MDL:MFCD00792507
CoE Number:468
XlogP3-AA:4.80 (est)
Molecular Weight:238.37062000
Formula:C15 H26 O2
NMR Predictor:Predict (works with chrome or firefox)
EFSA/JECFA Comments:
CASrn refers to (E)-isomer. Register name to be changed accordingly.
Category:flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books: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:1821 (E)-geranyl valerate
FLAVIS Number:09.150 (Old)
DG SANTE Food Flavourings:09.150 geranyl valerate
FEMA Number:4123 geranyl valerate
FDA Mainterm: GERANYL VALERATE
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.88700 to 0.89300 @ 25.00 °C.
Pounds per Gallon - (est).: 7.381 to 7.431
Refractive Index:1.46500 to 1.47100 @ 20.00 °C.
Boiling Point: 290.00 to 291.00 °C. @ 760.00 mm Hg
Vapor Pressure:0.000400 mm/Hg @ 25.00 °C. (est)
Flash Point:> 200.00 °F. TCC ( > 93.33 °C. )
logP (o/w): 5.698 (est)
Soluble in:
 alcohol
 water, 0.2279 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl valerate
allyl isovalerate
amyl valerate
amyl isovalerate
isoamyl valerate
isoamyl isovalerate
para-anisyl isovalerate
para-anisyl valerate
benzyl valerate
benzyl isovalerate
bornyl valerate
bornyl isovalerate
(-)-bornyl isovalerate
isobornyl isovalerate
S-sec-butyl thioisovalerate
butyl valerate
butyl isovalerate
isobutyl valerate
isobutyl isovalerate
carvyl isovalerate
cinnamyl valerate
cinnamyl isovalerate
citronellyl valerate
citronellyl isovalerate
para-cresyl valerate
para-cresyl isovalerate
cyclohexyl valerate
cyclohexyl isovalerate
cyclotene isovalerate
decyl valerate
decyl isovalerate
ethyl valerate
ethyl isovalerate
eugenyl isovalerate
furfuryl isovalerate
furfuryl valerate
geranyl isovalerate
(E)-2-hepten-1-yl isovalerate
heptyl isovalerate
sec-heptyl isovalerate
heptyl valerate
(E)-2-hexen-1-yl valerate
(E)-2-hexen-1-yl isovalerate
(Z)-3-hexen-1-yl valerate
(Z)-3-hexen-1-yl isovalerate
hexyl valerate
hexyl isovalerate
linalyl valerate
linalyl isovalerate
menthyl valerate
menthyl isovalerate
methyl 2-methyl valerate
methyl 4-methyl valerate
2-methyl butyl isovalerate
4-methyl pentyl isovalerate
methyl thio isovalerate
methyl valerate
methyl isovalerate
myrtenyl isovalerate
neryl isovalerate
nonyl isovalerate
nonyl valerate
octyl valerate
octyl isovalerate
phenethyl isovalerate
2-phenethyl valerate
3-phenyl propyl isovalerate
phenyl propyl valerate
S-prenyl thioisovalerate
isopropyl thioisovalerate
propyl valerate
propyl isovalerate
isopropyl valerate
isopropyl isovalerate
rhodinyl isovalerate
terpinyl isovalerate
terpinyl valerate
 
Organoleptic Properties:
Odor Type: floral
Odor Strength:medium
rose fruity pineapple
Odor Description:at 100.00 %. rose fruity pineapple
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Geranyl Valerate
CG Herbals
Geranyl Valerate Extra
Inoue Perfumery
GERANYL VALERATE S
Parchem
geranyl valerate
Prodasynth
GERANYL VALERATE >97%
Odor: FLORAL
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the Chemical Sources Association
 
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: flavor and fragrance agents
Recommendation for geranyl valerate usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.13 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 68.00 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 3900 (μg/person/day)
Threshold of Concern:1800 (μg/person/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: 22
 average usual ppmaverage maximum ppm
baked goods: 10.0000050.00000
beverages(nonalcoholic): 5.0000025.00000
beverages(alcoholic): --
breakfast cereal: 5.0000025.00000
cheese: 7.0000035.00000
chewing gum: --
condiments / relishes: 5.0000025.00000
confectionery froastings: 10.0000050.00000
egg products: --
fats / oils: 5.0000025.00000
fish products: 2.0000010.00000
frozen dairy: 7.0000035.00000
fruit ices: 10.0000050.00000
gelatins / puddings: 5.0000025.00000
granulated sugar: --
gravies: 20.00000100.00000
hard candy: --
imitation dairy: 7.0000035.00000
instant coffee / tea: --
jams / jellies: 5.0000025.00000
meat products: 2.0000010.00000
milk products: 7.0000035.00000
nut products: --
other grains: 5.0000025.00000
poultry: 2.0000010.00000
processed fruits: 7.0000035.00000
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 5.0000025.00000
snack foods: 10.0000050.00000
soft candy: --
soups: 5.0000025.00000
sugar substitutes: --
sweet sauces: 5.0000025.00000
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 7.0000035.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 5.0000025.00000
Edible ices, including sherbet and sorbet (03.0): 10.0000050.00000
Processed fruit (04.1): 7.0000035.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 10.0000050.00000
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 5.0000025.00000
Bakery wares (07.0): 10.0000050.00000
Meat and meat products, including poultry and game (08.0): 2.0000010.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 2.0000010.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 5.0000025.00000
Foodstuffs intended for particular nutritional uses (13.0): 10.0000050.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 5.0000025.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 10.0000050.00000
Ready-to-eat savouries (15.0): 20.00000100.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 5.0000025.00000
 
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 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 95 (FGE.95): Consideration of aliphatic, linear or branched-chain saturated and unsaturated alcohols, aldehydes, acids and related esters evaluated by JECFA (69th meeting) structurally related to esters of branched- and straight-chain aliphatic saturated primary alcohols and of one secondary alcohol, and branched- and straight-chain unsaturated carboxylic acids evaluated by EFSA in FGE.05Rev1 (2008)
View page or View pdf
EPI System: View
EPA Substance Registry Services (TSCA):10402-47-8
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5365850
National Institute of Allergy and Infectious Diseases:Data
[(2E)-3,7-dimethylocta-2,6-dienyl] pentanoate
Chemidplus:0010402478
 
References:
 [(2E)-3,7-dimethylocta-2,6-dienyl] pentanoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:10402-47-8
Pubchem (cid):5365850
Pubchem (sid):135041663
Flavornet:10402-47-8
Pherobase:View
 
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):HMDB40281
FooDB:FDB020001
Export Tariff Code:2915.60.0000
Typical G.C.
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aromatic
damascone carboxylate
FR
cheesy
heptanoic acid
FL/FR
chemical
propyl propionate
FL/FR
ethereal
propyl valerate
FL/FR
fatty
allyl decanoate
FL/FR
allyl octanoate
FL/FR
methyl 2-hexenoate
FL/FR
floral
benzyl isobutyrate
FL/FR
cassis buteneone
FR
citronellal diisotridecyl acetal
FR
(S)-
citronellyl acetate
FL/FR
citronellyl acetate
FL/FR
citronellyl anthranilate
FL/FR
citronellyl hexanoate
FL/FR
citronellyl propionate
FL/FR
(E)-
citronellyl tiglate
FL/FR
3-
cyclohexene-1-carboxylic acid, 2,6,6-trimethyl-, methyl ester
FR
beta-
damascenone
FL/FR
delta-
damascone
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
ethyl linalyl acetate
FR
ethyl ortho-anisate
FL/FR
eucalyptus macarthurii oil
FR
geraniol
FL/FR
geranium oil egypt fractions
FR
geranyl formate
FL/FR
geranyl isobutyrate
FL/FR
geranyl phenyl acetate
FL/FR
geranyl propionate
FL/FR
phenethyl isobutyrate
FL/FR
phenethyl isovalerate
FL/FR
phenethyl propionate
FL/FR
2-
phenethyl valerate
FL/FR
rhodinyl butyrate
FL/FR
rose butanoate
FL/FR
styralyl propionate
FL/FR
fresh
10-
undecen-1-yl acetate
FL/FR
fruity
allyl 3,5,5-trimethyl hexanoate
FL/FR
allyl cinnamate
FL/FR
allyl cyclohexyl acetate
FL/FR
allyl cyclohexyl butyrate
FL/FR
allyl heptanoate
FL/FR
allyl isononylate
FR
amyl propionate
FL/FR
iso
butyl hexanoate
FL/FR
butyl valerate
FL/FR
ethyl 3-(2-furyl) propanoate
FL/FR
ethyl 3-hexenoate
FL/FR
ethyl 3-methyl valerate
FL/FR
ethyl 5-hydroxyoctanoate
FL/FR
ethyl butyrate
FL/FR
ethyl cyclohexane propionate
FL/FR
ethyl heptanoate
FL/FR
ethyl hexanoate
FL/FR
(E)-
ethyl tiglate
FL/FR
ethyl-2-cyclopentenyl acetate
FR
(E,Z)-6-
ethyl-5,7-dimethyl-2,5-octadien-4-one
FR
geranyl butyrate
FL/FR
methyl hexanoate
FL/FR
methyl isovalerate
FL/FR
octyl formate
FL/FR
(E,E)-
pomarose
FR
iso
propyl hexanoate
FL/FR
iso
propyl isobutyrate
FL/FR
thesaron (Takasago)
FR
green
galbanum oxyacetate
FR
3-
hexenyl 2-methyl butyrate
FL/FR
hexyl phenyl acetate
FL/FR
pineapple heptadienone 10%
FR
spirogalbanone (Givaudan)
FR
herbal
geranium cyclohexane
FR
geranyl octanoate
FL/FR
herbal undecanone
FR
linalyl formate
FL/FR
nutty
2-
methyl-3-ethoxypyrazine
FL/FR
sulfurous
ethyl methyl mercaptopropionate
FL/FR
tropical
pina colada fragrance
FR
tropical 3-thiobutyrate
FL/FR
waxy
dihydrocitronellyl acetate
FL/FR
ethyl nonanoate
FL/FR
ethyl octanoate
FL/FR
winey
butyl angelate
FL/FR
woody
santalyl butyrate
FL/FR
For Flavor
No flavor group found for these
allyl 3,5,5-trimethyl hexanoate
FL/FR
allyl cinnamate
FL/FR
allyl cyclohexyl butyrate
FL/FR
allyl cyclohexyl valerate
FL
amyl propionate
FL/FR
butyl angelate
FL/FR
9-
decen-2-one
FL
dihydrocitronellyl acetate
FL/FR
ethyl 3-methyl valerate
FL/FR
ethyl 5-hydroxyoctanoate
FL/FR
ethyl cyclohexane propionate
FL/FR
ethyl cyclohexyl carboxylate
FL
ethyl ortho-anisate
FL/FR
geranyl octanoate
FL/FR
linalyl formate
FL/FR
methyl 2-hexenoate
FL/FR
2-
methyl-3-ethoxypyrazine
FL/FR
2-
phenethyl valerate
FL/FR
iso
propyl hexanoate
FL/FR
iso
propyl isobutyrate
FL/FR
propyl valerate
FL/FR
santalyl butyrate
FL/FR
citrus
citrus
styralyl propionate
FL/FR
fatty
allyl octanoate
FL/FR
floral
(S)-
citronellyl acetate
FL/FR
citronellyl acetate
FL/FR
citronellyl hexanoate
FL/FR
citronellyl propionate
FL/FR
dimethyl benzyl carbinyl acetate
FL/FR
geraniol
FL/FR
geranyl isobutyrate
FL/FR
geranyl phenyl acetate
FL/FR
phenethyl propionate
FL/FR
rhodinyl butyrate
FL/FR
fruity
allyl cyclohexyl acetate
FL/FR
allyl decanoate
FL/FR
allyl heptanoate
FL/FR
benzyl isobutyrate
FL/FR
iso
butyl hexanoate
FL/FR
butyl valerate
FL/FR
citronellyl anthranilate
FL/FR
ethyl 3-(2-furyl) propanoate
FL/FR
ethyl 3-hexenoate
FL/FR
ethyl butyrate
FL/FR
ethyl heptanoate
FL/FR
ethyl hexanoate
FL/FR
(E)-
ethyl tiglate
FL/FR
geranyl butyrate
FL/FR
hexyl phenyl acetate
FL/FR
methionyl butyrate
FL
methyl hexanoate
FL/FR
methyl isovalerate
FL/FR
(
methyl thio) methyl hexanoate
FL
phenethyl isovalerate
FL/FR
rose butanoate
FL/FR
greasy
10-
undecen-1-yl acetate
FL/FR
green
(E)-
citronellyl tiglate
FL/FR
geranyl formate
FL/FR
3-
hexenyl 2-methyl butyrate
FL/FR
octyl formate
FL/FR
honey
phenethyl isobutyrate
FL/FR
sulfurous
ethyl methyl mercaptopropionate
FL/FR
tropical 3-thiobutyrate
FL/FR
tropical
propyl propionate
FL/FR
waxy
ethyl nonanoate
FL/FR
ethyl octanoate
FL/FR
geranyl propionate
FL/FR
heptanoic acid
FL/FR
woody
beta-
damascenone
FL/FR
delta-
damascone
FL/FR
 
Potential Uses:
FRfloral
FRfruit
FRorchid
FL/FRosmanthus
FRrose
FRsassafras
FRtobacco
 
Occurrence (nature, food, other):note
 geranium leaf oil india @ 0.22%
Data GC Search Trop Picture
 geranium oil rwanda @ 0.18%
Data GC Search Trop Picture
 geranium petiole oil india @ 0.37%
Data GC Search Trop Picture
 geranium stem oil india @ 0.11%
Data GC Search Trop Picture
 sassafras leaf
Search Trop Picture
 
Synonyms:
(2E)-3,7-dimethyl-2,6-octadienyl pentanoate
(2E)-3,7-dimethylocta-2,6-dien-1-yl pentanoate
(2E)-3,7-dimethylocta-2,6-dien-1-yl valerate
[(2E)-3,7-dimethylocta-2,6-dienyl] pentanoate
 geraniol valerate
 geranyl pentanoate
(E)-geranyl valerate
 geranyl valerate S
(E)-neryl valerate
 pentanoic acid (2E)-3,7-dimethyl-2,6-octadienyl ester
 pentanoic acid geranyl ester
 pentanoic acid, (2E)-3,7-dimethyl-2,6-octadien-1-yl ester
 pentanoic acid, (2E)-3,7-dimethyl-2,6-octadienyl ester
 pentanoic acid, 3,7-dimethyl-2,6-octadienyl ester, (E)-
(E)-valeric acid 3,7-dimethyl-2,6-octadienyl ester
 
 
Notes:
Isol. from sassafras oil
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