mango furanone
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :2,5-dimethylfuran-3-one
InChI :InChI=1/C6H8O2/c1-4-3-6(7)5(2)8-4/h3,5H,1-2H3
InChIKey :ASOSVCXGWPDUGN-UHFFFAOYAI
SMILES :CC1C(=O)C=C(O1)C
(EINECS) number :238-365-5
cas number :14400-67-0
fema number :4101
coe number :11066
fl. number :13.119
molar refractivity :29.19 ± 0.3 cm3
parachor :248.0 ± 6.0 cm3
index of refraction :1.455 ± 0.02
surface tension :28.3 ± 3.0 dyne/cm
density :1.042 ± 0.06 g/cm3
polarizability :11.57 ± 0.5 10-24cm3
xlogp : 0.60
molecular weight : 112.1265200
formula :C6 H8 O2
 
 
fda reg :unspecified h. number :2932.19.0000
organoleptics : 
odor type :caramellic
odor strength :high ,
recommend smelling in a 1.00 % solution or less
odor description :
at 1.00 % in dipropylene glycol.  
fruity ester caramel
properties : 
appearence :yellow clear liquid
assay : 92.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.04100 - 1.07000 @ 20.00 °C.
pounds per gallon - calc. : 8.672 to 8.914
refractive index :1.47000 - 1.49000 @ 20.00 °C.
boiling point : 260.00 - 261.00 °C. @ 760.00 mm Hg
logp : 0.33
safety : 
most important hazard(s) : Xi - Irritant
  
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 125.00  °F.  TCC  ( 51.67 °C. )
  
recommendation for mango furanone usage levels up to :
  0.5000 % 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).
publication number : 22.
4101 average usual ppmaverage maximum ppm
baked goods : 5.0000025.00000
beverages(nonalcoholic) : --
beverages(alcoholic) : --
breakfast cereal : 2.0000010.00000
cheese : 3.0000015.00000
chewing gum : 4.0000020.00000
condiments / relishes : --
confectionery froastings : 4.0000020.00000
egg products : --
fats / oils : 2.0000010.00000
fish products : 1.000005.00000
frozen dairy : 3.0000015.00000
fruit ices : 3.0000015.00000
gelatins / puddings : 3.0000015.00000
granulated sugar : --
gravies : 2.0000010.00000
hard candy : 4.0000020.00000
imitation dairy : --
instant coffee / tea : --
jams / jellies : 2.0000010.00000
meat products : 1.000005.00000
milk products : 3.0000015.00000
nut products : --
other grains : --
poultry : 1.000005.00000
processed fruits : 2.0000010.00000
processed vegetables : --
reconstituted vegetables : --
seasonings / flavors : 2.0000010.00000
snack foods : 5.0000025.00000
soft candy : 4.0000020.00000
soups : 2.0000010.00000
sugar substitutes : --
sweet sauces : --
safety links : 
(EINECS) number :238-365-5
chemidplus :014400670
epa-srs :14400-67-0
  
other : 
 
references : 
fl. number :13.119
pubchem :662593
NIST Chemistry WebBook :2725829975
  
synonyms :
2,3-dihydro-2,5-dimethyl-3-furanone
2,5-dimethyl furan-3(2H)-one
2,5-dimethyl-2,3-dihydrofuran-3-one
2,5-dimethyl-2H-furan-3-one
2,5-dimethyl-3(2H)-furanone
 mango furanone
soluble in :
 alcohol
 water, slightly
insoluble in :
 water
(odor and/or flavor) blends with :
 acetoin
2-acetyl furan
 acetyl propionyl
3-acetyl-2,5-dimethyl furan
2-acetyl-3,4,5,6-tetrahydropyridine
2-acetyl-3,5(or 6)-dimethyl pyrazine
 allyl 2-furoate
isoamyl 3-(2-furan) propionate
 benzyl disulfide
 butyl levulinate
2-oxobutyric acid
gamma-butyrolactone
 caramel dione
 caramel furanone
 caramel pentadione
 cyclohexyl acetic acid
 diacetyl
2,5-diethyl tetrahydrofuran
alpha,alpha-dimethyl anisyl acetone
2,3-dimethyl pyrazine
 ethyl (E)-crotonate
 ethyl 2-hydroxy-2-methyl butyrate
 ethyl 4-pentenoate
 ethyl cyclopentenolone
 ethyl maltol
 ethyl pyruvate
(E)-ethyl tiglate
 ethyl vanillin
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-one
5-ethyl-3,4,5,6-tetramethyl cyclohexen-2-one
 fenugreek absolute
 furfuryl acetone
 furfuryl alcohol
 furfuryl octanoate
 furfuryl valerate
 geranyl crotonate
gamma-heptalactone
3,4-hexane dione
5-hydroxymethyl furfural
 immortelle absolute
 levulinic acid
 maltol
 maltyl propionate
 maple furanone
 maple lactone
 menthone lactone
 mesitene lactone
3-methyl butyl 2-furyl butyrate
 methyl cyclopentenolone
5-methyl furfural
4-methyl-2,6-dimethoxyphenol
 nutty cyclohexenone
 peanut oxazole
2-pentanoyl furan
 rosefuran
 shoyu furanone
 strawberry furanone
 strawberry furanone acetate
dextro,laevo-tartaric acid
 tetrahydrofurfuryl acetate
 tetrahydrofurfuryl alcohol
2-thiophene thiol
(E)-tiglic acid
 toffee furanone
 tonka bean absolute
 tonka bean resinoid
(E,E)-2,4-undecadien-1-al
2,4-undecadien-1-al
isovaleraldehyde propylene glycol acetal
 vanilla oleoresin
 vanillyl isobutyrate
(odor and/or flavor) used in :
 bread
 caramel
 coffee
 mango
 strawberry
natural occurrence in :
bread
coffee
mango



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