(E)-2-hexen-1-al dimethyl acetal
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(E)-1,1-dimethoxyhex-2-ene
InChI :InChI=1/C8H16O2/c1-4-5-6-7-8(9-2)10-3/h6-8H,4-5H2,1-3H3/b7-6+
InChIKey :OSVRJMZINDGZFB-VOTSOKGWBV
SMILES :CCC\C=C\C(OC)OC
(EINECS) number :242-204-4
cas number :18318-83-7
beilstein number :4242579
fema number :4098
jecfa number :1728
fl. number :06.072
molar refractivity :42.61 ± 0.3 cm3
parachor :374.3 ± 4.0 cm3
index of refraction :1.423 ± 0.02
surface tension :25.0 ± 3.0 dyne/cm
density :0.861 ± 0.06 g/cm3
polarizability :16.89 ± 0.5 10-24cm3
xlogp : 2.20
molecular weight : 144.2114400
formula :C8 H16 O2
 
 
fda reg :unspecified h. number :2911.00.5000
organoleptics : 
odor type :fruity
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
fruity apple
properties : 
appearence :colorless clear liquid
assay : 97.00 - 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.86100 - 0.87100 @ 25.00 °C.
pounds per gallon - calc. : 7.164 to 7.248
refractive index :1.41500 - 1.42500 @ 20.00 °C.
boiling point : 70.00 °C. @ 15.00 mm Hg
logp : 2.24
safety : 
Oral Toxicity(LD50) : Oral-Rat    1700.00  mg/kg    
Dermal Toxicity(LD50) : Skin-Rabbit  5.00  gm/kg    
  
flash point ( Deg. F. ) : 135.00  °F.  TCC  ( 57.22 °C. )
  
IFRA critical Effect :Sensitization
recommendation for (E)-2-hexen-1-al dimethyl acetal usage levels up to :
 PROHIBITED : Should not be used as a fragrance ingredient.
  
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.
4098 average usual ppmaverage maximum ppm
baked goods : 10.0000050.00000
beverages(nonalcoholic) : 5.0000025.00000
beverages(alcoholic) : --
breakfast cereal : 5.0000025.00000
cheese : 7.0000035.00000
chewing gum : --
condiments / relishes : 5.0000025.00000
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 : 5.0000025.00000
granulated sugar : --
gravies : 20.00000100.00000
hard candy : --
imitation dairy : 7.0000035.00000
instant coffee / tea : --
jams / jellies : 5.0000025.00000
meat products : 2.0000010.00000
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 : 10.0000050.00000
soft candy : --
soups : 5.0000025.00000
sugar substitutes : --
sweet sauces : 5.0000025.00000
safety links : 
(EINECS) number :242-204-4
chemidplus :018318837
epa-srs :18318-83-7
  
ifra :ifra - ( Found under : trans-2-Hexenal dimethyl acetal )
other : 
 
references : 
pubchem :664409
  
synonyms :
1,1-dimethoxy-(E)-2-hexene
(E)-1,1-dimethoxyhex-2-ene
trans-1,1-dimethoxyhex-2-ene
1,1-dimethoxyhex-2(E)-ene
(E)-2-hexen-1-al dimethyl acetal
trans-2-hexen-1-al dimethyl acetal
(E)-2-hexenal dimethyl acetal
trans-2-hexenal dimethyl acetal
soluble in :
 alcohol
insoluble in :
 water
stability :
 alkalis
(odor and/or flavor) used in :
 apple
 fruit
natural occurrence in :
found in nature



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 06/12/2008