(Z)-4-decen-1-yl acetate 67452-27-1

(Z)-4-decen-1-yl acetate

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IUPAC name :

[(Z)-dec-4-enyl] acetate

InChI :

InChI=1/C12H22O2/c1-3-4-5-6-7-8-9-10-11-14-12(2)13/h7-8H,3-6,9-11H2,1-2H3/b8-7-

InChIKey :

OVBJYGLPPVUWAV-FPLPWBNLBB

SMILES :

CCCCC\C=C/CCCOC(=O)C

cas number :	67452-27-1
fema number :	3967
jecfa number :	1288
fl. number :	09.918
molar refractivity :	59.47 ± 0.3 cm3
parachor :	521.5 ± 4.0 cm3
index of refraction :	1.444 ± 0.02
surface tension :	29.5 ± 3.0 dyne/cm
density :	0.886 ± 0.06 g/cm3
polarizability :	23.57 ± 0.5 10-24cm3
xlogp :	4.50
molecular weight :	198.3018800
formula :	C12 H22 O2

export tariff code :

unspecified

fda reg :

unspecified

organoleptics :

odor type :

floral

odor strength :

medium

odor description :
at 100.00 %.

oily floral rose spicy

properties :

appearence :

colorless clear liquid

assay :

98.00 to 100.00 %

Food Chemicals Codex Listed :

specific gravity :

0.87800 to 0.88800 @ 25.00 °C.

pounds per gallon - calc. :

7.306 to 7.389

refractive index :

1.43800 to 1.44000 @ 20.00 °C.

boiling point :

60.00 °C. @ 0.05 mm Hg

boiling point :

226.00 to 227.00 °C. @ 760.00 mm Hg

acid value :

1.00 max. KOH/g

logp :

4.29

safety :

Oral Toxicity(LD50) :

Not determined

Dermal Toxicity(LD50) :

Not determined

flash point ( Deg. F. ) :

150.00 °F. TCC ( 65.56 °C. )

recommendation for (Z)-4-decen-1-yl acetate usage levels up to :

4.0000 % 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 : 20.

3967

average usual ppm

average maximum ppm

baked goods :

4.00000

8.00000

beverages(nonalcoholic) :

2.00000

4.00000

beverages(alcoholic) :

2.00000

4.00000

breakfast cereal :

cheese :

chewing gum :

10.00000

20.00000

condiments / relishes :

confectionery froastings :

egg products :

fats / oils :

fish products :

frozen dairy :

3.00000

6.00000

fruit ices :

gelatins / puddings :

granulated sugar :

gravies :

2.00000

4.00000

hard candy :

4.00000

8.00000

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 :

3.00000

5.00000

soups :

2.00000

4.00000

sugar substitutes :

sweet sauces :

safety links :

chemidplus :

067452271

EPA Substance Registry Services :

67452-27-1

NLM Chemical Carcinogenesis Research Information System :

67452-27-1

NLM Developmental and Reproductive Toxicity :

67452-27-1

NLM Env. Mutagen Info. Center :

67452-27-1

NLM GENetic TOXicology :

67452-27-1

EPI System :

view

other :

references :

jecfa number :

1288

fl. number :

09.918

pubchem :

188433

NIST Chemistry WebBook :

366295131

synonyms :
(Z)-4-	decen-1-yl acetate
cis-4-	decen-1-yl acetate
(Z)-4-	decenyl acetate
cis-4-	decenyl acetate
soluble in :
	alcohol
insoluble in :
	water
(odor and/or flavor) blends with :
	butyl angelate
2-	decalinyl formate
2-	ethyl-1-hexanol
	geranium oil
	geranium rose-scented oil (pelargonium spp.) cuba
	jasmin acetate
	phenethyl pivalate
	rhodinyl acetate
	rhodinyl isobutyrate
	rose absolute morocco
	rose concrete bulgaria
	rose oil morocco
(Z)-	rose oxide
	violet decenol
	woody acetate
(odor and/or flavor) used in :
	floral
	lilac lilas syringa
	orchid
	oriental
	peony
	rose
natural occurrence in :
	grapefruit juice

information only - not sold by The Good Scents Company.

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