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tropical dienoate (Bedoukian)
ethyl 4,7-octadienoate and ethyl Z-4-octenoate

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Fragrance Demo Formulas
Name:ethyl (4E)-octa-4,7-dienoate
CAS Number: 72276-09-6Picture of molecule3D/inchi
% from:60.00% to 80.00%
ECHA EINECS - REACH Pre-Reg:276-569-6
FDA UNII: Search
Nikkaji Web:J299.085G
XlogP3-AA:2.50 (est)
Molecular Weight:168.23592000
Formula:C10 H16 O2
NMR Predictor:Predict (works with chrome, Edge or firefox)
Also(can) Contains:ethyl (Z)-4-octenoate 15 - 30%
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
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Refractive Index:1.44000 to 1.44600 @ 20.00 °C.
Flash Point: 167.00 °F. TCC ( 75.00 °C. )
Shelf Life: 12.00 month(s) or longer if stored properly.
Soluble in:
 alcohol
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: fruity
Odor Strength:high ,
recommend smelling in a 10.00 % solution or less
Substantivity: < 24 hour(s) at 100.00 %
sweet ethereal juicy pineapple pear mango passion fruit
Odor Description:at 10.00 % in dipropylene glycol. sweet ethereal juicy pineapple pear mango passion fruit
Flavor Type: fruity
ripe juicy pineapple
Taste Description: ripe juicy fresh pineapple
Odor and/or flavor descriptions from others (if found).
Bedoukian Research
Tropical Dienoate 96.0% (sum of isomers), Kosher, Halal
Odor Description:Powerful sweet-ethereal, juicy, pineapple and shades of pear, mango and passion fruit
Can be useful in floral and citrus compositions to impart warmth of tropical fruits to the top and middle notes in particular.
Taste Description:Powerful, ripe, juicy, characteristic of fresh pineapple
Excellent for pineapple notes. Works well in other tropical fruits flavors, especially mango and passion fruit. Not for use in Tobacco or Nicotine delivery device applications and/or products.
 
Cosmetic Information:
None found
 
Suppliers:
Bedoukian Research
Tropical Dienoate 96.0% (sum of isomers), Kosher, Halal
Odor: Powerful sweet-ethereal, juicy, pineapple and shades of pear, mango and passion fruit
Use: Can be useful in floral and citrus compositions to impart warmth of tropical fruits to the top and middle notes in particular.
Flavor: Powerful, ripe, juicy, characteristic of fresh pineapple
Excellent for pineapple notes. Works well in other tropical fruits flavors, especially mango and passion fruit. Not for use in Tobacco or Nicotine delivery device applications and/or products.
 
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
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
Recommendation for tropical dienoate (Bedoukian) flavor usage levels up to:
  10.0000 ppm in the finished product.
 
Safety References:
EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):72276-09-6
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5352798
National Institute of Allergy and Infectious Diseases:Data
ethyl (4E)-octa-4,7-dienoate
Chemidplus:0072276096
 
References:
 ethyl (4E)-octa-4,7-dienoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:72276-09-6
Pubchem (cid):5352798
Pubchem (sid):135120999
Pherobase:View
 
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
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2916.19.6000
ChemSpider:View
 
Potential Blenders and core components note
For Odor
fruity
allyl hexanoate
FL/FR
butyl isovalerate
FL/FR
ethyl 2-octenoate
FL/FR
ethyl-2-cyclopentenyl acetate
FR
linalyl hexanoate
FL/FR
methyl (Z)-4-decenoate
FL/FR
3-
phenyl propyl isobutyrate
FL/FR
pineapple hydroxyhexanoate
FL/FR
propyl heptanoate
FL/FR
propyl hexanoate
FL/FR
green
(E)-2-
hexen-1-yl valerate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
sorbyl isobutyrate
FL/FR
For Flavor
No flavor group found for these
linalyl hexanoate
FL/FR
methyl (Z)-4-decenoate
FL/FR
(E,E)-
sorbyl isobutyrate
FL/FR
sorbyl isobutyrate
FL/FR
fruity
fruity
allyl hexanoate
FL/FR
butyl isovalerate
FL/FR
ethyl (E)-2-octenoate
FL
ethyl 2-octenoate
FL/FR
(Z)-5-
octen-1-yl acetate
FL
passion fruit distillates
FL
3-
phenyl propyl isobutyrate
FL/FR
pineapple hydroxyhexanoate
FL/FR
propyl hexanoate
FL/FR
green
(E)-2-
hexen-1-yl valerate
FL/FR
waxy
propyl heptanoate
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 ethyl (Z)-4-octenoate and ethyl 4,7-octadienoate
 ethyl 4,7-octadienoate and ethyl (Z)-4-octenoate
 ethyl 4,7-octadienoate and ethyl Z-4-octenoate
 ethyl Z-4-octenoate and ethyl 4,7-octadienoate
4,7-octadienoic acid, ethyl ester and 4-octenoic acid, ethyl ester, (4Z)-
4-octenoic acid, ethyl ester, (4Z)- and 4,7-octadienoic acid, ethyl ester
 
 
Notes:
None found
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