decanal propylene glycol acetal
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :4-methyl-2-nonyl-1,3-dioxolane
InChI :InChI=1/C13H26O2/c1-3-4-5-6-7-8-9-10-13-14-11-12(2)15-13/h12-13H,3-11H2,1-2H3
InChIKey :SJLDHKPBFAHHSI-UHFFFAOYAK
SMILES :CCCCCCCCCC1OCC(O1)C
(EINECS) number :226-536-7
cas number :5421-12-5
fema number :4364
jecfa number :1744
molar refractivity :63.51 ± 0.3 cm3
parachor :571.2 ± 4.0 cm3
index of refraction :1.433 ± 0.02
surface tension :30.0 ± 3.0 dyne/cm
density :0.878 ± 0.06 g/cm3
polarizability :25.17 ± 0.5 10-24cm3
xlogp : 5.00
molecular weight : 214.3443400
formula :C13 H26 O2
BioActivity Analysis :72608
 
 
export tariff code :unspecified
fda reg :unspecified
 
 

organoleptics :
odor type :green
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
green floral

properties :
appearence :colorless clear liquid
assay : 98.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.88100 - 0.88700 @ 25.00 °C.
pounds per gallon - calc. : 7.331 to 7.381
refractive index :1.43300 - 1.43900 @ 20.00 °C.
boiling point : 270.00 - 271.00 °C. @ 760.00 mm Hg
acid value : 1.00  max.  KOH/g
logp : 4.51

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 214.00  °F.  TCC  ( 101.11 °C. )
  
recommendation for decanal propylene glycol acetal usage levels up to :
  3.0000 % 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).
publication number : 23.
4364 average usual ppmaverage maximum ppm
baked goods : 10.0000050.00000
beverages(nonalcoholic) : 1.0000010.00000
beverages(alcoholic) : --
breakfast cereal : 1.0000030.00000
cheese : 1.0000030.00000
chewing gum : 10.0000050.00000
condiments / relishes : 0.2000040.00000
confectionery froastings : 0.2000040.00000
egg products : 1.0000030.00000
fats / oils : 1.00000100.00000
fish products : 0.2000040.00000
frozen dairy : 0.2000040.00000
fruit ices : 2.0000040.00000
gelatins / puddings : 0.2000040.00000
granulated sugar : --
gravies : 1.0000030.00000
hard candy : 1.00000100.00000
imitation dairy : 1.0000030.00000
instant coffee / tea : --
jams / jellies : --
meat products : 0.2000040.00000
milk products : 2.0000030.00000
nut products : 1.0000030.00000
other grains : 1.0000030.00000
poultry : 1.0000030.00000
processed fruits : --
processed vegetables : --
reconstituted vegetables : --
seasonings / flavors : 1.00000100.00000
snack foods : 1.0000030.00000
soft candy : 1.00000100.00000
soups : 0.2000040.00000
sugar substitutes : --
sweet sauces : --

safety links :
(EINECS) number :226-536-7
chemidplus :005421125
epa-srs :5421-12-5
dtp/nci :6643
  

other :
 

references :
jecfa number :1744
pubchem :672549
  
synonyms :
 aldehyde C-10 propylene glycol acetal
 decanal propylene glycol acetal
 decanal propyleneglycol acetal
4-methyl-2-nonyl-1,3-dioxolane
2-nonyl-4-methyl-1,3-dioxolane
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
isoamyl 3-(2-furan) propionate
 amyl benzoate
 anisyl propanal / methyl anthranilate schiff's base
 benzyl methyl ether
isobutyl benzyl carbinol
alpha-butyl cinnamaldehyde
 chrysanthemum oxide
 cinnamyl formate
 citral dimethyl acetal
 citronellyl acetate
 citronellyl propionate
 clary sage absolute
 cumin carbinol
 cuminyl acetaldehyde
3-decanone
(E)-4-decen-1-al
2-decen-1-al
 dimethyl benzyl carbinol
 dimethyl benzyl carbinyl butyrate
 dimethyl succinate
6,8-dimethyl-2-nonanol
 earthy acetal
 ethyl 2-benzyl butyrate
 ethyl methyl-para-tolyl glycidate
2-ethyl octine carbonate
 farnesyl acetate
 floral butanal
 gardenia absolute
 gardenia concrete
 geranium oil
 geranyl acetone
 geranyl isobutyrate
 grapefruit pentanol
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
 hyacinth absolute
 hydroxycitronellal diethyl acetal
 ivy carbaldehyde / methyl anthranilate schiff's base
 ivy dioxolane
 jasmin cyclopentanol
 jonquil absolute
 marine hexane
 methyl 2-undecynoate
 methyl cyclocitrone
para-methyl hydratropaldehyde
 methyl octine carbonate
4-methyl-4-phenyl pentanone
 mimosa absolute
 muguet undecadienal
 neroli oil
 nerolidol
(E)-nerolidol
 ocean propanal / methyl anthranilate schiff's base
 octanal dimethyl acetal
 octyl oxyacetaldehyde
 orange leaf absolute
 papaya isobutyrate
 peach pivalate
 phenyl acetaldehyde
 phenyl acetaldehyde diisobutyl acetal
2-phenyl propionaldehyde ethylene glycol acetal
 rose butanoate
 styralyl formate
 sweet pea absolute
 terpinyl isobutyrate
 tricyclodecenyl acetate
isovaleraldehyde propylene glycol acetal
(odor and/or flavor) used in :
 floral
 green
natural occurrence in :
not found in nature



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