phloretin
 
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IUPAC name :3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl)propan-1-one
InChI :InChI=1/C15H14O5/c16-10-4-1-9(2-5-10)3-6-12(18)15-13(19)7-11(17)8-14(15)20/h1-2,4-5,7-8,16-17,19-20H,3,6H2
InChIKey :VGEREEWJJVICBM-UHFFFAOYAB
SMILES :C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2O)O)O)O
(EINECS) number :200-488-7
cas number :60-82-2
beilstein number :1887240
fema number :4390
molar refractivity :72.92 ± 0.3 cm3
parachor :564.4 ± 4.0 cm3
index of refraction :1.684 ± 0.02
surface tension :74.8 ± 3.0 dyne/cm
density :1.429 ± 0.06 g/cm3
polarizability :28.91 ± 0.5 10-24cm3
xlogp : 1.70
molecular weight : 274.2686600
formula :C15 H14 O5
BioActivity Analysis :477076
 
 
fda reg :unspecified h. number :2914.50.2000
organoleptics : 
properties : 
appearence :white to pale yellow solid
assay : 99.00 - 100.00 %   
Food Chemicals Codex Listed :No
melting point : 263.00 - 264.00 °C. @ 760.00 mm Hg
boiling point : 534.00 - 535.00 °C. @ 760.00 mm Hg
logp : 3.51
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 556.00  °F.  TCC  ( 291.11 °C. )
  
recommendation for phloretin 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 : 23.
4390 average usual ppmaverage maximum ppm
baked goods : 30.00000300.00000
beverages(nonalcoholic) : 20.00000300.00000
beverages(alcoholic) : 40.00000300.00000
breakfast cereal : 30.00000300.00000
cheese : 40.00000300.00000
chewing gum : 40.00000400.00000
condiments / relishes : --
confectionery froastings : 20.00000200.00000
egg products : --
fats / oils : 40.00000200.00000
fish products : 30.00000200.00000
frozen dairy : 20.00000200.00000
fruit ices : 30.00000300.00000
gelatins / puddings : 20.00000200.00000
granulated sugar : 20.00000300.00000
gravies : 20.00000300.00000
hard candy : 20.00000300.00000
imitation dairy : 20.00000400.00000
instant coffee / tea : 20.00000400.00000
jams / jellies : 20.00000400.00000
meat products : 20.00000200.00000
milk products : 20.00000300.00000
nut products : 20.00000300.00000
other grains : --
poultry : --
processed fruits : --
processed vegetables : --
reconstituted vegetables : --
seasonings / flavors : 30.00000300.00000
snack foods : 30.00000300.00000
soft candy : 30.00000300.00000
soups : 10.00000100.00000
sugar substitutes : 20.00000200.00000
sweet sauces : 20.00000200.00000
safety links : 
(EINECS) number :200-488-7
toxnet :60-82-2
epa-srs :60-82-2
pubchem :60-82-2
  
other : 
 
references : 
synonyms :
 dihydronaringenin
3-(4-hydroxyphenyl)-1-(2,4,6-trihydroxyphenyl) propan-1-one
beta-(para-hydroxyphenyl)-2,4,6-trihydroxypropiophenone
 naringenin dihydrochalcone
 phloretin
2',4',6'-trihydroxy-3-(para-hydroxyphenyl) propiophenone
soluble in :
 alcohol
 water, 123 mg/L @ 16C
insoluble in :
 water
natural occurrence in :
 not found in nature



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