undecanal propylene glycol acetal 74094-62-5

undecanal propylene glycol acetal

organoleptics properties safety references FEMA Index Home Page

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IUPAC name :

2-decyl-4-methyl-1,3-dioxolane

InChI :

InChI=1/C14H28O2/c1-3-4-5-6-7-8-9-10-11-14-15-12-13(2)16-14/h13-14H,3-12H2,1-2H3

InChIKey :

ZOJCTKZSRSUPTO-UHFFFAOYAW

SMILES :

CCCCCCCCCCC1OCC(O1)C

cas number :	74094-62-5
fema number :	4374
jecfa number :	1745
molar refractivity :	68.14 ± 0.3 cm3
parachor :	611.0 ± 4.0 cm3
index of refraction :	1.436 ± 0.02
surface tension :	30.3 ± 3.0 dyne/cm
density :	0.876 ± 0.06 g/cm3
polarizability :	27.01 ± 0.5 10-24cm3
XlogP :	5.60
molecular weight :	228.3709200
formula :	C14 H28 O2
NMR Predictor :	Predict

export tariff code :

unspecified

fda reg :

unspecified

organoleptics :

odor type :

fatty

odor strength :

medium ,
recommend smelling in a 10.00 % solution or less

odor description :
at 10.00 % in dipropylene glycol.

sweet fatty floral

properties :

appearence :

colorless clear liquid

assay :

95.00 to 100.00 %

Food Chemicals Codex Listed :

specific gravity :

0.87900 to 0.88500 @ 25.00 °C.

pounds per gallon - calc. :

7.314 to 7.364

refractive index :

1.43500 to 1.44100 @ 20.00 °C.

boiling point :

286.00 to 287.00 °C. @ 760.00 mm Hg

acid value :

1.00 max. KOH/g

vapor pressure :

0.00800 mm/Hg @ 25.00 °C.

flash point :

229.00 °F. TCC ( 109.44 °C. )

logP (o/w) :

5.04

safety :

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

Inhalation Toxicity(LC50) :

Not determined

safety in use :

recommendation for undecanal propylene glycol acetal usage levels up to :

2.0000 % 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).

The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA on the "LIBRARY" link.

publication number : 23

average usual ppm

average maximum ppm

baked goods :

beverages(nonalcoholic) :

0.50000

2.50000

beverages(alcoholic) :

breakfast cereal :

cheese :

chewing gum :

5.00000

25.00000

condiments / relishes :

confectionery froastings :

egg products :

fats / oils :

fish products :

frozen dairy :

fruit ices :

1.00000

5.00000

gelatins / puddings :

granulated sugar :

gravies :

hard candy :

1.00000

5.00000

imitation dairy :

instant coffee / tea :

jams / jellies :

meat products :

milk products :

nut products :

other grains :

poultry :

processed fruits :

processed vegetables :

reconstituted vegetables :

seasonings / flavors :

snack foods :

soft candy :

soups :

sugar substitutes :

sweet sauces :

safety references :

EPI System :

view

2-decyl-4-methyl-1,3-dioxolane

chemidplus :

74094-62-5

EPA Substance Registry Services :

74094-62-5

dtp/nci :

22582

references :

2-decyl-4-methyl-1,3-dioxolane

jecfa number :

1745

pubchem :

84720

other :

synonyms :
	aldehyde C-11 undecylic propylene glycol acetal
2-	decyl-4-methyl-1,3-dioxolane
	undecanal propyleneglycol acetal
soluble in :
	alcohol
insoluble in :
	water
(odor and/or flavor) blends with :
alpha-	amyl cinnamaldehyde / methyl anthranilate schiff's base
	benzyl lactate
	decanol
(E)-4-	decen-1-al
3,7-	dimethyl-6-octenoic acid
	gardenia concrete
	honeysuckle absolute
	lily of the valley absolute
	methyl undecylenate
	mimosa concrete france
	nonanol
	petal pyranone
(odor and/or flavor) used in :
	floral
natural occurrence in :
	not found in nature

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