EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

benzyl methyl tiglate
benzyl 2,3-dimethylcrotonate

Sponsors

Name:benzyl 2,3-dimethylbut-2-enoate
CAS Number: 7492-69-5Picture of molecule3D/inchi
FDA UNII:Q2Z1O33EAA
Nikkaji Web:J1.536.419J
CoE Number:11868
XlogP3-AA:3.40 (est)
Molecular Weight:204.26892000
Formula:C13 H16 O2
NMR Predictor:Predict (works with chrome or firefox)
Category:flavoring 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
Pubchem Patents:Search
PubMed:Search
NCBI:Search
JECFA Food Flavoring:847 benzyl 2,3-dimethylcrotonate
FLAVIS Number:09.508 (Old)
DG SANTE Food Flavourings:09.508 benzyl 2,3-dimethylcrotonate
FEMA Number:2143 benzyl 2,3-dimethylcrotonate
FDA Mainterm: BENZYL 2,3-DIMETHYLCROTONATE
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.
 
Physical Properties:
Appearance:colorless to pale yellow clear oily liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:1.01700 to 1.02300 @ 25.00 °C.
Pounds per Gallon - (est).: 8.462 to 8.512
Refractive Index:1.51000 to 1.51700 @ 20.00 °C.
Boiling Point: 259.00 °C. @ 760.00 mm Hg
Acid Value: 1.00 max. KOH/g
Vapor Pressure:0.002000 mm/Hg @ 25.00 °C. (est)
Flash Point: 296.00 °F. TCC ( 146.67 °C. )
logP (o/w): 3.454 (est)
Soluble in:
 alcohol
 water, 17.87 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items:note
allyl tiglate
amyl tiglate
isoamyl tiglate
benzyl tiglate
butyl tiglate
isobutyl tiglate
cinnamyl tiglate
(E)-citronellyl tiglate
(E)-ethyl tiglate
geranyl methyl tiglate
geranyl tiglate
(Z)-3-hexen-1-yl tiglate
hexyl tiglate
methyl tiglate
3-octyl tiglate
phenethyl tiglate
propyl tiglate
isopropyl tiglate
 
Organoleptic Properties:
Odor Type: herbal
Odor Strength:medium ,
recommend smelling in a 10.00 % solution or less
warm herbal fruity spicy
Odor Description:at 10.00 % in dipropylene glycol. warm herbal fruity spicy
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Parchem
Benzyl Methyl Tiglate
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: flavoring agents
Recommendation for benzyl methyl tiglate usage levels up to:
 not for fragrance use.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA): 1.00 (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
 average usual ppmaverage maximum ppm
baked goods: -1.50000
beverages(nonalcoholic): -0.75000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: -2.80000
fruit ices: -2.80000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: -1.80000
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: --
 
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 20 (FGE.20): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical group 23
View page or View pdf
Flavouring Group Evaluation 54 (FGE.54)[1] - Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20 (2005) - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food
View page or View pdf
Flavouring Group Evaluation 20, Revision 1 (FGE.20Rev1): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters from chemical group 23
View page or View pdf
Flavouring Group Evaluation 54, Revision 1 (FGE.54Rev1): Consideration of benzyl derivatives evaluated by JECFA (57th meeting) structurally related to benzyl alcohols, benzaldehydes, a related acetal, benzoic acids and related esters evaluated by EFSA in FGE.20Rev1 (2009)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 20, Revision 2 (FGE.20Rev2): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 20, Revision 3(FGE.20Rev3): Benzyl alcohols, benzaldehydes, a related acetal, benzoic acids, and related esters from chemical groups 23 and 30
View page or View pdf
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :61402
National Institute of Allergy and Infectious Diseases:Data
benzyl 2,3-dimethylbut-2-enoate
Chemidplus:0007492695
 
References:
 benzyl 2,3-dimethylbut-2-enoate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:7492-69-5
Pubchem (cid):61402
Pubchem (sid):135018884
 
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):HMDB36224
FooDB:FDB015082
ChemSpider:View
 
Potential Blenders and core components note
For Odor
aldehydic
agrumen nitrile
FR
floral
butyl tiglate
FR
cassis cyclohexene
FR
menthadienyl formate
FR
rose carboxylate
FR
rose undecene
FR
fruity
allyl amyl glycolate
FR
ethyl 2-cyclohexyl propionate
FR
ethyl 3,5,5-trimethyl hexanoate
FR
heptanal cyclic ethylene acetal
FR
nerolidyl isobutyrate
FR
rhubarb undecane
FR
tropical indene
FR
green
carrot leaf oil (daucus carota ssp.maximus)
FR
privet dioxane
FR
violet dienyne
FR
herbal
chamomile propionate
FR
chamomile valerate
FR
herbal acetal
FR
nonisyl acetate
FR
tricyclodecenyl propionate
FR
woody
patchouli absolute
FR
verdoxan
FR
For Flavor
No flavor group found for these
(±)-(cis+trans)-1,2-
dihydroperillaldehyde
FL
2,4-
dimethyl anisole
FL
2-
hexenal
FL
2-
hexenal diethyl acetal
FL
hexyl (E)-2-hexenoate
FL
(E)-2-
methyl-2-octenal
FL
2-
methyl-2-octenal
FL
3-
methyl-3-pentanol
FL
(E,E)-3,5-
octadien-2-one
FL
althaea officinalis root tincture
FL
hexyl 3-mercaptobutanoate
FL
acidic
acidic
(E)-2-
hexenoic acid
FL
caramellic
5-
ethyl-3,4,5,6-tetramethyl cyclohexen-2-one
FL
creamy
althaea officinalis root extract
FL
2,4-
heptadienal
FL
fatty
2,4-
undecadienal
FL
fruity
ethyl (E)-2-octenoate
FL
furfuryl propionate
FL
methyl (E)-3-nonenoate
FL
green
(E)-2-
hexenal diethyl acetal
FL
methyl 2-undecynoate
FL
 
Potential Uses:
 fruit
FLgreen
FLherbal
FLspice
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benzyl 2,3-dimethyl crotonate
 benzyl 2,3-dimethyl-2-butenoate
 benzyl 2,3-dimethylbut-2-enoate
 benzyl 2,3-dimethylcrotonate
 benzyl methyltiglate
2-butenoic acid, 2,3-dimethyl-, phenylmethyl ester
 crotonic acid, 2,3-dimethyl-, benzyl ester
2,3-dimethyl crotonic acid benzyl ester
2,3-dimethyl-2-butenoic acid benzyl ester
2,3-dimethyl-2-butenoic acid phenyl methyl ester
 phenyl methyl 2,3-dimethyl-2-butenoate
 phenylmethyl 2,3-dimethyl-2-butenoate
 phenylmethyl 2,3-dimethylbut-2-enoate
 
 
Notes:
Flavouring agent
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