methyl formyl anthranilate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :methyl 2-formamidobenzoate
InChI :InChI=1/C9H9NO3/c1-13-9(12)7-4-2-3-5-8(7)10-6-11/h2-6H,1H3,(H,10,11)
InChIKey :HRNPZFOYXWWMFL-UHFFFAOYAY
SMILES :COC(=O)C1=CC=CC=C1NC=O
(EINECS) number :255-287-7
cas number :41270-80-8
fema number :4171
jecfa number :1549
fl. number :09.650
molar refractivity :47.82 ± 0.3 cm3
parachor :379.8 ± 4.0 cm3
index of refraction :1.578 ± 0.02
surface tension :48.3 ± 3.0 dyne/cm
density :1.243 ± 0.06 g/cm3
polarizability :18.95 ± 0.5 10-24cm3
xlogp : 1.40
molecular weight : 179.1726600
formula :C9 H9 N O3
 
 
export tariff code :unspecified
fda reg :unspecified
 

organoleptics :
odor type :fruity
odor strength :medium
odor description :
at 100.00 %.  
fruity grape

properties :
appearence :pale yellow solid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
melting point : 53.00 °C. @ 760.00 mm Hg
boiling point : 367.00 to 368.00 °C. @ 760.00 mm Hg
acid value : 2.00  max.  KOH/g
logp : 2.25

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
Maximised Survey-derived Daily Intakes (MSDI-EU) :0.12 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :0.20 (μg/capita/day)
modified Theoretical Added Maximum Daily Intake (mTAMDI) :2300 (μg/person/day)
Threshold of concern :1800 (μg/person/day)
flash point ( Deg. F. ) : 349.00  °F.  TCC  ( 176.11 °C. )
recommendation for methyl formyl anthranilate usage levels up to :
 not for fragrance use.
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).
publication number : 22.
4171 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 links :
 
 
(EINECS) number :255-287-7
chemidplus :041270808
EPA Substance Registry Services :41270-80-8
NLM Chemical Carcinogenesis Research Information System :41270-80-8
NLM Developmental and Reproductive Toxicity :41270-80-8
NLM Env. Mutagen Info. Center :41270-80-8
NLM GENetic TOXicology :41270-80-8
EPI System :view

other :

references :
jecfa number :1549
fl. number :09.650
pubchem :739981
NIST Chemistry WebBook :1163823218
synonyms :
 methyl 2-(formyl amino) benzoate
 methyl formyl aminobenzoate
 methyl formyl anthranilate
 methyl N-formylanthranilate

soluble in :
 alcohol
 water, slightly

insoluble in :
 water

(odor and/or flavor) blends with :
 acetone
6-acetoxydihydrotheaspirane
 allyl anthranilate
 apple crotonate
 benzyl anthranilate
 butyl anthranilate
isobutyl anthranilate
isobutyl isobutyrate
isobutyl methyl anthranilate
 cassis oxime 10%
 cinnamyl anthranilate
 cinnamyl propionate
 cognac oil white
 curacao peel oil
 decyl anthranilate
 dihydronootkatone
2,4-dimethyl-3-cyclohexene-1-methanyl acetate
(E,E)-2,4-dodecadien-1-al
 ethyl 3-hydroxyhexanoate
 ethyl anthranilate
 ethyl decanoate
 ethyl propionate
 fig crotonate
 furfuryl butyrate
 gardenia amide
 gardenia decalone
 gardenia pentyl acetate
 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
3-hexanone
(Z)-3-hexen-1-yl anthranilate
(E)-2-hexen-1-yl isovalerate
 hexyl isobutyrate
 lime oil distilled terpeneless
 magnolia indene
1-para-menthene-8-thiol
4-mercapto-4-methyl-2-pentanol
 methyl anthranilate
 myrmac aldehyde
beta-naphthyl ethyl ether
 neryl acetate
 nootkatone
 octanal / methyl anthranilate schiff's base
3-octyl acetate
 peony acetonitrile
 petitgrain mandarin oil
 petitgrain mandarin oil terpeneless
 phenethyl anthranilate
isopropenyl acetate
 propyl heptanoate
 rhubarb furan
alpha-terpinyl methyl ether
 tridecanal
(±)-2,4,8-trimethyl-7-nonen-2-ol
 valencene

(odor and/or flavor) used in :
 fruit
 grape
 curacao
 grape
 grape concord grape
 grape white grape
 grapefruit
 lychee soapberry
 raisin
 starfruit

natural occurrence in :
data pagechampaca concrete @ 0.10%



information only - not sold by The Good Scents Company.



Please share your Information / Comments.

Your email Address:



Top of Page          The Good Scents Company Home

Copyright © 1980-2008 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 11/25/2008