ethyl acetate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :ethyl acetate
InChI :InChI=1/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3
InChIKey :XEKOWRVHYACXOJ-UHFFFAOYAD
SMILES :CCOC(=O)C
(EINECS) number :205-500-4
eu annex :607-022-00-5
cas number :141-78-6
fema number :2414
coe number :191
jecfa number :27
fl. number :09.001
molar refractivity :22.35 ± 0.3 cm3
parachor :216.0 ± 4.0 cm3
index of refraction :1.373 ± 0.02
surface tension :23.5 ± 3.0 dyne/cm
density :0.898 ± 0.06 g/cm3
polarizability :8.86 ± 0.5 10-24cm3
xlogp : 0.70
molecular weight : 88.1051200
formula :C4 H8 O2
BioActivity Analysis :17389574
 
 
fda reg :unspecified h. number :2915.31.0000
organoleptics : 
odor type :ethereal
odor strength :high ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in propylene glycol.  
ethereal fruity sweet rum
taste description³ :at 100.00 ppm.  
Etherial, fruity, sweet, with a grape and cherry nuance
substantivity :4  Hour(s)
properties : 
appearence :colorless clear liquid
assay : 98.00 - 100.00 %   
Food Chemicals Codex Listed :Yes
specific gravity :0.89400 - 0.89800 @ 25.00 °C.
pounds per gallon - calc. : 7.439 to 7.472
refractive index :1.37000 - 1.37500 @ 20.00 °C.
melting point : -84.00 - -83.00 °C. @ 760.00 mm Hg
boiling point : 76.50 - 77.50 °C. @ 760.00 mm Hg
boiling point : 26.00 - 27.00 °C. @ 100.00 mm Hg
acid value : 5.00  max.  KOH/g
logp : 0.73
safety : 
most important hazard(s) : Xi - Irritant
  
Oral Toxicity(LD50) : Oral-Rat    5620.00  mg/kg  YKYUA6  32,1241,1981
Dermal Toxicity(LD50) : Skin-Rabbit  >20.00  ml/kg    
  
flash point ( Deg. F. ) : 24.00  °F.  TCC  ( -4.44 °C. )
  
recommendation for ethyl acetate usage levels up to :
  10.0000 % in the fragrance concentrate.
  
recommendation for ethyl acetate usage levels up to :
  1400.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :205-500-4
rtecs :AH5425000 for 141-78-6
chemidplus :000141786
epa-srs :141-78-6
  
other : 
 
references : 
jecfa number :27
fl. number :09.001
pubchem :152007
NIST Chemistry WebBook :3389793962
  
reference : Mosciano, Gerard P&F 19, No. 5, 79, (1994)³
synonyms :
 acetic acid ethyl ester
 acetic ether
 acetoxyethane
 ethyl acetate
 ethyl acetic ester
 ethyl ethanoate
 vinegar naphtha
soluble in :
 alcohol
 glycerin
 propylene glycol
 water, 80000 mg/L @ 25C
(odor and/or flavor) blends with :
 acetaldehyde
 acetaldehyde diisoamyl acetal
 allyl amyl glycolate
 allyl hexanoate
 allyl nonanoate
 allyl phenyl acetate
isoamyl acetate
isoamyl acetoacetate
isoamyl alcohol
isoamyl butyrate
 amyl formate
 amyl heptanoate
isoamyl isovalerate
isoamyl laurate
 amyl octanoate
isoamyl pyruvate
isoamyl tiglate
2-amyl-5 or 6-keto-1,4-dioxane
para-anisyl alcohol
 benzaldehyde dimethyl acetal
 benzyl acetate
 benzyl cinnamate
 benzyl isobutyrate
 benzyl methyl ether
 benzyl propionate
 bergamot oil
 berry pentadienoate
 blood orange oil
 bois de rose oil
isobutyl acetate
isobutyl acetoacetate
isobutyl alcohol
 butyl angelate
 butyl anthranilate
isobutyl butyrate
 butyl decanoate
 butyl formate
isobutyl formate
 butyl hexanoate
 butyl undecylenate
isobutyraldehyde propylene glycol acetal
 citral
 citronella oils
 citronellyl acetate
 citrus carbaldehyde
 clary sage concrete
 clary sage oil
 cognac oil green
 cognac oil white
 coriander seed oil
 cyclamen aldehyde
 cyclohexanone diethyl acetal
 decanal
 decyl propionate
 diethyl 1-malate
 diethyl laevo-tartrate
 diethyl malate
 diethyl malonate
 diethyl sebacate
 dihydromyrcenol
 dimethyl anthranilate
 ethyl (E)-crotonate
 ethyl 2-methyl-2-pentenoate
 ethyl 3,5,5-trimethyl hexanoate
 ethyl aconitate
2-ethyl butyl acetate
2-ethyl butyraldehyde
 ethyl butyrate
 ethyl chrysanthemate
 ethyl cinnamate
 ethyl cyclopentenolone
 ethyl heptanoate
 ethyl hydrocinnamate
 ethyl nonanoate
 ethyl octanoate
 ethyl propionate
 ethyl pyruvate
2-ethyl-4-butanol
 eucalyptus oil
 farnesyl acetone
 fir needle oil
 fruity carboxylate
 galbanum oil
 geranyl acetate
 geranyl acetoacetate
 geranyl methyl tiglate
 grapefruit oil
 grapefruit pentanol
 green acetate
2-heptenoic acid
 heptyl acetate
2-hexanol
3-hexanone
(Z)-3-hexen-1-ol
(Z)-3-hexen-1-yl 2-methyl butyrate
(Z)-3-hexen-1-yl acetate
(Z)-3-hexen-1-yl butyrate
(E)-2-hexen-1-yl formate
(E)-2-hexen-1-yl phenyl acetate
(Z)-3-hexen-1-yl propionate
1-hexen-3-ol
1-hexen-3-yl acetate
 hexyl acetate
 hexyl isobutyrate
 hexyl isovalerate
 hexyl phenyl acetate
 ho leaf oil
 leaf acetal
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
 linalyl propionate
 melon heptenal
 melon nonenoate
 methyl 2-methyl valerate
 methyl acetate
2-methyl allyl butyrate
 methyl decanoate
 methyl ethyl ketone
 methyl heptenone
 methyl hydrocinnamate
 methyl nonanoate
 methyl propionate
S-(methyl thio) hexanoate
 methyl tiglate
2-methyl valeraldehyde
2-methyl-1-butanol
 neryl acetate
 nonanal
 nopyl acetate
 octanal
2-pentanone
(Z)-2-penten-1-ol
 petitgrain oil
 phenethyl acetate
 phenethyl senecioate
2-phenyl propyl butyrate
 prenyl formate
 propionaldehyde
isopropyl acetate
isopropyl butyrate
 propyl formate
 propyl heptanoate
isopropyl propionate
 pyruvaldehyde
 raspberry ketone
 rum ether
 sorbyl butyrate
 sorbyl propionate
 strawberry furanone
 styralyl acetate
alpha-terpineol
alpha-terpinyl acetate
 terpinyl cinnamate
 tetrahydrofurfuryl acetate
 tetrahydrolinalool
 woody acetate
(odor and/or flavor) used in :
 almond
 almond bitter almond
 apple
 apricot
 banana
 beer
 blackberry
 brandy
 bubblegum
 butterscotch
 cheese cheddar cheese
 cherry
 cherry brandy
 chocolate cacao
 chocolate cocoa
 coffee
 cologne
 cranberry
 currant
 date
 ginger
 gooseberry
 grape
 grenadine
 honey miel
 hops houblon
 huckleberry bilberry
 lemon
 lime
 magnolia
 malt
 melon watermelon muskmelon cantaloupe
 mulberry
 nut pistachio
 orange
 orris iris
 peach
 pear
 pineapple
 plum
 plum mirabelle plum
 quince
 raspberry
 rum
 strawberry
 tangerine
 tea
 tomato
 woodruff asperula
 ylang ylang cananga
natural occurrence in :
beer
cider
cognac
honey
data pagemangrove bark red oil cuba @ 10.00%
data pageosmanthus absolute @ 0.06%
data pagepersea americana mill. fruit oil cuba @ trace%
raspberry plant
rum
data pagestar fruit oil cuba @ 0.10%
tomato
vinegar
whiskey
wine red wine



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 08/26/2008