(E,E)-digeranyl ether
(2E)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethylocta-2,6-diene
 
Notes:
None found
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      Product(s):
      31147-36-1 (2E,6E)-1,1'-oxybis[3,7-dimethylocta-2,6-diene]
       
  • CSA
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CAS Number: 31147-36-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 250-486-5
FDA UNII: 3011189T3J
Nikkaji Web: J278.054B
XlogP3-AA: 6.80 (est)
Molecular Weight: 290.49018000
Formula: C20 H34 O
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
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PubMed: Search
NCBI: Search
JECFA Food Flavoring: 2142  digeranyl ether
DG SANTE Food Flavourings: 03.024  digeranyl ether
FEMA Number: 4664 digeranyl ether
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):31147-36-1 ; DIGERANYL ETHER
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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: 0.86700 to 0.87600 @  25.00 °C.
Pounds per Gallon - (est).: 7.214 to  7.289
Refractive Index: 1.47700 to 1.48700 @  20.00 °C.
Boiling Point: 371.00 to  373.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.000020 mmHg @ 25.00 °C. (est)
Flash Point: 331.00 °F. TCC ( 166.11 °C. )
logP (o/w): 7.537 (est)
Soluble in:
 alcohol
 water, 0.001203 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: floral
 
Odor Strength: medium
 
 clean  floral  balsamic  
Odor Description:
at 100.00 %. 
clean floral balsamic
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
(2E,6E)-1,1'-oxybis[3,7-dimethylocta-2,6-diene]
Parchem
(E,E)-digeranyl ether
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the CSA
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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.
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
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 49.00 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 14000 (μg/person/day)
Threshold of Concern:540 (μg/person/day)
Structure Class: II
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: 24
Click here to view publication 24
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): 15.0000030.00000
beverages(alcoholic): 30.0000060.00000
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: 70.00000100.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: 50.00000100.00000
gelatins / puddings: 50.00000100.00000
granulated sugar: --
gravies: --
hard candy: 70.00000100.00000
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: 50.00000100.00000
soups: --
sugar substitutes: --
sweet sauces: --
 
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): --
Fats and oils, and fat emulsions (type water-in-oil) (02.0): --
Edible ices, including sherbet and sorbet (03.0): 50.00000100.00000
Processed fruit (04.1): --
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 70.00000100.00000
Chewing gum (05.0): --
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): --
Bakery wares (07.0): --
Meat and meat products, including poultry and game (08.0): --
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): --
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): --
Foodstuffs intended for particular nutritional uses (13.0): --
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 15.0000030.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 30.0000060.00000
Ready-to-eat savouries (15.0): --
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 50.00000100.00000
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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):
Scientific Opinion on Flavouring Group Evaluation 23, Revision 2 (FGE.23Rev2): Aliphatic, alicyclic and aromatic ethers including anisole derivatives from chemical groups 15, 16, 22, 26 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 59, Revision 1 (FGE.59Rev1): Consideration of aliphatic and aromatic ethers evaluated by JECFA (61st meeting and 63rd meeting) structurally related to aliphatic, alicyclic and aromatic ethers including anisole derivatives evaluated by EFSA in FGE.23 Rev2 (2010)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 23, Revision 3 (FGE.23Rev3): Aliphatic, alicyclic and aromatic ethers including anisole derivatives from chemical groups 15, 16, 22, 26 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 23, Revision 4 (FGE.23Rev4): Aliphatic, alicyclic and aromatic ethers including anisole derivatives from chemical groups 15, 16, 22, 26 and 30
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 31147-36-1
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 6441535
National Institute of Allergy and Infectious Diseases: Data
 (2E)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethylocta-2,6-diene
Chemidplus: 0031147361
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References:
 (2E)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethylocta-2,6-diene
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 6441535
Pubchem (sid): 135125543
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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
HMDB (The Human Metabolome Database): Search
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
aldehydic
(Z)-8-undecenalFR
balsamic
 benzyl benzoateFL/FR
 cinnamyl cinnamateFL/FR
 cyclohexyl benzoateFL/FR
alpha-methyl cinnamyl alcoholFR
 santolina oil 
citrus
 dihydromyrcenolFL/FR
floral
 autumn carboxylateFR
 azalea fragranceFR
 cananga oilFL/FR
 cananga oil chinaFL/FR
(E)-cinnamophenone 
 citronellyl acetoneFL/FR
 cyclohexyl salicylateFR
 dimethyl anthranilateFL/FR
 dimethyl benzyl carbinolFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
 hydroxycitronellolFL/FR
 mimusops elengi flower oilFR
 muguet shiseolFL/FR
cis-muguet shiseolFL/FR
 narcissus acetateFL/FR
 neryl benzoateFL/FR
 petitgrain mandarin oil terpenelessFL/FR
 phenethyl salicylateFL/FR
3-phenyl propyl propionateFL/FR
 phytolFL/FR
(Z,E)-phytolFL/FR
2-isopropoxyethyl salicylateFR
isopropyl benzoateFL/FR
fruity
 heptyl butyrateFL/FR
green
(E)-2-hexen-1-yl salicylateFR
herbal
 cananga fruit oilFR
 eucalyptus citriodora oilFR
green tea leaf absoluteFL/FR
honey
 methyl hydrocinnamateFL/FR
musk
 musk gx 50% in DEPFR
 musk gx 50% in DPGFR
 musk gx 50% in IPMFR
spicy
 amyl isoeugenolFR
 cananga leaf oilFR
 cinnamaldehyde / methyl anthranilate schiff's baseFR
 cinnamyl acetateFL/FR
isoeugenyl acetateFL/FR
black poplar bud absoluteFR
sulfurous
4-methoxy-alpha-toluene thiol 
woody
(Z)-woody amyleneFR
 
For Flavor
 
No flavor group found for these
(E)-cinnamophenone 
 citronellyl acetoneFL/FR
 cyclohexyl benzoateFL/FR
4-methoxy-alpha-toluene thiol 
 methyl hydrocinnamateFL/FR
 neryl benzoateFL/FR
3-phenyl propyl propionateFL/FR
isopropyl benzoateFL/FR
 santolina oil 
 yuzunoneFL
balsamic
 benzyl benzoateFL/FR
(Z,E)-phytolFL/FR
floral
 cananga oilFL/FR
 cananga oil chinaFL/FR
pseudoiononeFL
 muguet shiseolFL/FR
cis-muguet shiseolFL/FR
 phytolFL/FR
fruity
 dimethyl anthranilateFL/FR
 petitgrain mandarin oil terpenelessFL/FR
green
 dihydromyrcenolFL/FR
 heptyl butyrateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
 narcissus acetateFL/FR
medicinal
 dimethyl benzyl carbinolFL/FR
 phenethyl salicylateFL/FR
powdery
 hydroxycitronellolFL/FR
spicy
 cinnamyl acetateFL/FR
 cinnamyl cinnamateFL/FR
isoeugenyl acetateFL/FR
tea
green tea leaf absoluteFL/FR
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 rosa gullicu
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Synonyms:
1,1’-oxybis(3,7-dimethyl-(2E)-octadiene)
(2E,6E)-1,1'-oxybis(3,7-dimethyl-2,6-octadiene)
(2E,2'E)-1,1'-oxybis[3,7-dimethyl-2,6-octadiene]
bis[(2E)-3,7-dimethylocta-2,6-dien-1-yl] ether
(2E)-1-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-3,7-dimethylocta-2,6-diene
(2E,6E)-1,1'-oxybis(3,7-dimethylocta-2,6-diene)
(2E,6E)-1,1'-oxybis[3,7-dimethylocta-2,6-diene]
(2E)-1-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3,7-dimethylocta-2,6-diene
(E,E)-geranyl neryl ether
2,6-octadiene, 1,1'-oxybis[3,7-dimethyl-, (2E,2'E)-
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