phenethyl acetal
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Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :1-ethoxyethoxybenzene
InChI :InChI=1/C10H14O2/c1-3-11-9(2)12-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3
InChIKey :WDAPDTRODNUPPB-UHFFFAOYAJ
SMILES :CCOC(C)OC1=CC=CC=C1
cas number :5426-78-8
(EINECS) number :226-572-3
molar refractivity :48.53 ± 0.3 cm3
parachor :400.3 ± 4.0 cm3
index of refraction :1.483 ± 0.02
surface tension :30.9 ± 3.0 dyne/cm
density :0.979 ± 0.06 g/cm3
polarizability :19.24 ± 0.5 10-24cm3
XlogP : 2.80
molecular weight : 166.2169600
formula :C10 H14 O2
BioActivity Analysis :78532
 
 
export tariff code :2911.00.5000
fda reg :unspecified

Suppliers :
Berje :Phenyl Ethyl Acetal
Penta :phenethyl acetal

organoleptics :
odor type :green
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :¹
at 10.00 % in dipropylene glycol.  
green fresh leaf stem cortex rose
odor sample from :Givaudan Corporation
substantivity :196  Hour(s)

properties :
appearence :colorless clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.01800 to 1.02000 @ 25.00 °C.
pounds per gallon - calc. : 8.471 to 8.487
refractive index :1.52800 to 1.53200 @ 20.00 °C.
boiling point : 225.00 to 226.00 °C. @ 760.00 mm Hg
flash point : 174.00  °F.  TCC  ( 78.89 °C. )
logP (o/w) : 2.41

safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for phenethyl acetal usage levels up to :
  2.0000 % in the fragrance concentrate.
recommendation for phenethyl acetal usage levels up to :
 not for flavor use.

safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 1-ethoxyethoxybenzene
(EINECS) number :226-572-3
chemidplus :005426788
EPA Substance Registry Services :5426-78-8
dtp/nci :14332

references :
 1-ethoxyethoxybenzene
pubchem :672641

Cosmetics :
Cosmetic uses : perfuming agents

other :
reference : Luebke, William tgsc, (1993)¹
CosIng :cosmetic data
synonyms :
 acetaldehyde ethyl phenyl acetal
(1-ethoxyethoxy) benzene
1-ethoxyethoxybenzene
alpha-ethoxyphenetole
 phenyl ethyl acetal

soluble in :
 alcohol
 dipropylene glycol

insoluble in :
 water

(odor and/or flavor) blends with :
 acetaldehyde butyl phenethyl acetal
 acetaldehyde di-(Z)-3-hexen-1-yl acetal
 acetaldehyde ethyl phenethyl acetal
 allyl anthranilate
 allyl nonanoate
 anisyl propanal / methyl anthranilate schiff's base
 basil absolute sweet
2-isobutyl thiazole
 cumin acetaldehyde
neocyclocitral
 dimethyl benzyl carbinol
2,4-dimethyl cyclohexyl methyl acetate
 diphenyl oxide
 galbanum oil terpeneless
 galbanum oleoresin
 geranium absolute
 heptyl cinnamate
 herbal heptane
(E)-2-hexen-1-al
2-hexen-1-al
3-hexen-1-al
(E)-2-hexen-1-ol
(Z)-2-hexen-1-ol
2-hexen-1-ol
3-hexen-1-ol
(E)-2-hexen-1-yl acetate
(Z)-3-hexen-1-yl benzoate
(Z)-3-hexen-1-yl lactate
(Z)-3-hexen-1-yl methyl carbonate
 hexoxyacetaldehyde dimethyl acetal
 hexyl heptanoate
 ivy carbaldehyde
2,4-ivy carbaldehyde
3,5-ivy carbaldehyde
3,6-ivy carbaldehyde
2,4-ivy carbaldehyde / methyl anthranilate schiff's base
 ivy dioxolane
 leaf acetal
 leafy acetal
 leafy oxime
 methyl heptine carbonate
3-methyl-3-pentanol
 narcissus absolute
(E,Z)-2,6-nonadien-1-yl acetate
 ocean propanal / methyl anthranilate schiff's base
 octanal dimethyl acetal
(E)-2-octen-1-al
(Z)-2-octen-1-al
(Z)-5-octen-1-yl propionate
 orangeflower absolute
 petitgrain combava oil
 phenoxyacetaldehyde 50% in benzyl alcohol
 phenyl acetaldehyde diisobutyl acetal
3-phenyl propionaldehyde
 propyl cinnamate
isopropyl phenyl acetate
isopropyl phenyl propionaldehyde
isopropyl quinoline
isopulegyl formate
 rose absolute
 rose leaf absolute
laevo-rose oxide
 rosemary oleoresin
 styralyl acetate
 tetrahydrofurfuryl cinnamate

(odor and/or flavor) used in :
 fern fougere
 gardenia
 green
 hyacinth jacinthe
 lilac lilas syringa
 rose
 topnotes

natural occurrence in :
not found in nature



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