ethyl ethyl anthranilate
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IUPAC name :ethyl 2-ethylaminobenzoate
InChI :InChI=1/C11H15NO2/c1-3-12-10-8-6-5-7-9(10)11(13)14-4-2/h5-8,12H,3-4H2,1-2H3
InChIKey :VKRBJLSSQUIOHL-UHFFFAOYAY
SMILES :CCNC1=CC=CC=C1C(=O)OCC
cas number :38446-21-8
(EINECS) number :253-935-3
fema number :4115
coe number :629
jecfa number :1547
fl. number :09.764
molar refractivity :56.90 ± 0.3 cm3
parachor :450.5 ± 4.0 cm3
index of refraction :1.545 ± 0.02
surface tension :39.4 ± 3.0 dyne/cm
density :1.074 ± 0.06 g/cm3
polarizability :22.55 ± 0.5 10-24cm3
XlogP : 2.90
molecular weight : 193.2423000 (IUPAC)
formula :C11 H15 N O2
NMR Predictor :Predict
 
 
export tariff code :2922.49.3800
fda reg :unspecified

Suppliers :
Nanjing :ethyl 2-(ethylamino)benzoate

organoleptics :
odor type :floral
odor strength :medium
odor description :
at 100.00 %.  
fruity neroli tangerine petitgrain

properties :
appearence :pale yellow solid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
melting point : 74.00 °C. @ 760.00 mm Hg
boiling point : 260.00 °C. @ 760.00 mm Hg
acid value : 1.00  max.  KOH/g
flash point : 260.00  °F.  TCC  ( 126.67 °C. )
logP (o/w) : 3.76

safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :0.06 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :0.09 (μg/capita/day)
modified Theoretical Added Maximum Daily Intake (mTAMDI) :2300 (μg/person/day)
Threshold of concern :1800 (μg/person/day)
 
recommendation for ethyl ethyl anthranilate usage levels up to :
  5.0000 % in the fragrance concentrate.
 
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 on the "LIBRARY" link.
publication number : 22
 average usual ppmaverage maximum ppm
baked goods : 10.0000050.00000
beverages(nonalcoholic) : --
beverages(alcoholic) : --
breakfast cereal : 5.0000025.00000
cheese : 7.0000035.00000
chewing gum : --
condiments / relishes : 2.0000025.00000
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 : --
granulated sugar : --
gravies : 5.0000025.00000
hard candy : --
imitation dairy : 7.0000035.00000
instant coffee / tea : --
jams / jellies : --
meat products : 5.0000025.00000
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 : 20.00000100.00000
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 (EFFA, 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 (EFFA, 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) : --
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...
EPI System :view
Canada Domestic Sub. List :Yes
 
 
 
 ethyl 2-ethylaminobenzoate
(EINECS) number :253-935-3
chemidplus :038446218
EPA Substance Registry Services :38446-21-8

references :
 ethyl 2-ethylaminobenzoate
fl. number :09.764
jecfa number :1547
pubchem :198417

other :
synonyms :
 diethyl anthranilate
 ethyl (2-ethyl aminophenyl) methanoate
 ethyl 2-(ethyl amino) benzoate
 ethyl 2-ethylaminobenzoate
2-(ethyl aminobenzoic acid ethyl ester
 ethyl N-ethylanthranilate
 ethyl ortho-(ethyl amino) benzoate

soluble in :
 alcohol
 water, very slightly

insoluble in :
 water

(odor and/or flavor) blends with :
6-acetoxydihydrotheaspirane
 allyl anthranilate
 apple crotonate
 benzyl anthranilate
 bigarade oxide
 blood orange oil
 blood orange oil (citrus sinensis l. var. sanguinello) italy
 blood orange oil (citrus sinensis l. var. tarocco) italy
 butyl anthranilate
isobutyl anthranilate
isobutyl isobutyrate
isobutyl methyl anthranilate
 cassis bud oil
 cassis oxime 10%
 cinnamyl anthranilate
 cinnamyl propionate
 citronellyl anthranilate
 cognac oil white
 curacao peel oil
 cyclamen aldehyde / methyl anthranilate schiff's base
 cyclohexyl anthranilate
 decanal dimethyl acetal
 decyl anthranilate
 dihydronootkatone
1,3-dimethoxybenzene
 dimethyl anthranilate
2,4-dimethyl-3-cyclohexene-1-methanyl acetate
(E,E)-2,4-dodecadien-1-al
 ethyl 3-hydroxyhexanoate
 ethyl anthranilate
 ethyl decanoate
 ethyl methyl anthranilate
 ethyl propionate
 farnesene
 fig crotonate
 frangipani absolute pink
 furfuryl butyrate
 gardenia amide
 gardenia decalone
 gardenia pentyl acetate
 geranyl anthranilate
 geranyl formate
 grape butyrate
 grape notes
 grapefruit acetal
 grapefruit indene
 grapefruit menthane
 grapefruit nitrile
 grapefruit octenone
 grapefruit oil
 grapefruit oil CO2 extract
 grapefruit oil terpeneless
 grapefruit pentanol
 green carboxylate
 herbal carene
3-hexanone
(Z)-3-hexen-1-yl anthranilate
(E)-2-hexen-1-yl isovalerate
 hexyl isobutyrate
 lime oil distilled terpeneless
 linalyl cinnamate
 linalyl phenyl acetate
 magnolia indene
1-para-menthene-8-thiol
4-mercapto-4-methyl-2-pentanol
 methyl anthranilate
 methyl formyl anthranilate
alpha-methylene citronellal
 mikan peel oil
 myrmac aldehyde
beta-naphthyl anthranilate
beta-naphthyl ethyl ether
beta-naphthyl methyl ether
beta-naphthyl methyl ketone
 nerol
 neroli oil
 neroli oil CO2 extract
 nerolidyl acetate
 neryl acetate
 nootkatone
 octanal / methyl anthranilate schiff's base
3-octyl acetate
 orangeflower water absolute
 peony acetonitrile
 petitgrain cedrat oil
 petitgrain combava oil
 petitgrain heptane
 petitgrain mandarin oil
 petitgrain mandarin oil terpeneless
 petitgrain oil
 phenethyl anthranilate
(E)-2-phenyl-1(2)-propene-1-yl acetate
isopropenyl acetate
isopropyl anthranilate
 propyl heptanoate
 rhubarb furan
 tangerine acetate
 tangerine nitrile
 tangerine oil
 tangerine oil terpeneless
alpha-terpinyl methyl ether
 tridecanal
(E)-2-tridecen-1-al
2-tridecen-1-al
(±)-2,4,8-trimethyl-7-nonen-2-ol
 valencene
 ylang ylang oil
 ylang ylang oil CO2 extract
 ylang ylang oil I
 ylang ylang oil II
 ylang ylang oil III

(odor and/or flavor) used in :
 fruit
 fruit tropical fruit
 mandarin
 neroli
 orange
 petitgrain
 tangerine

natural occurrence in :
not found in nature



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