ethyl salicylate
Notes :
Modifier for methyl salicylate.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :ethyl 2-hydroxybenzoate
InChI :InChI=1/C9H10O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6,10H,2H2,1H3
InChIKey :GYCKQBWUSACYIF-UHFFFAOYAH
SMILES :CCOC(=O)C1=CC=CC=C1O
(EINECS) number :204-265-5
cas number :118-61-6
beilstein number :0907659
fema number :2458
coe number :432
jecfa number :900
fl. number :09.748
molar refractivity :44.54 ± 0.3 cm3
parachor :366.9 ± 4.0 cm3
index of refraction :1.538 ± 0.02
surface tension :44.2 ± 3.0 dyne/cm
density :1.168 ± 0.06 g/cm3
polarizability :17.65 ± 0.5 10-24cm3
xlogp : 3.00
molecular weight : 166.1739000
formula :C9 H10 O3
BioActivity Analysis :73905
 
 
fda reg :unspecified h. number :2918.23.0000
organoleptics : 
odor type :minty
odor strength :medium
odor description :
at 100.00 %.  
sweet wintergreen mint floral tutti frutti spicy balsam
taste description³ :at 10.00 ppm.  
Sweet, wintergreen, spicy and anisic
substantivity :4  Hour(s)
properties : 
appearence :colorless clear liquid
assay : 99.00 - 100.00 %   
Food Chemicals Codex Listed :Yes
specific gravity :1.12700 - 1.13000 @ 25.00 °C.
pounds per gallon - calc. : 9.378 to 9.403
refractive index :1.52100 - 1.52300 @ 20.00 °C.
melting point : 2.00 - 3.00 °C. @ 760.00 mm Hg
boiling point : 233.00 - 235.00 °C. @ 760.00 mm Hg
boiling point : 107.00 - 108.00 °C. @ 12.00 mm Hg
acid value : 1.00  max.  KOH/g
logp : 2.95
safety : 
most important hazard(s) : Xn - Harmful.
  
Oral Toxicity(LD50) : Oral-Rat    1320.00  mg/kg    
Dermal Toxicity(LD50) : Skin-Rabbit  >5000.00  mg/kg    
  
flash point ( Deg. F. ) : 225.00  °F.  TCC  ( 107.22 °C. )
  
recommendation for ethyl salicylate usage levels up to :
  6.0000 % in the fragrance concentrate.
  
recommendation for ethyl salicylate usage levels up to :
  20.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :204-265-5
rtecs :VO3000000 for 118-61-6
chemidplus :000118616
epa-srs :118-61-6
dtp/nci :8209
  
other : 
 
references : 
jecfa number :900
fl. number :09.748
pubchem :151511
NIST Chemistry WebBook :995676495
  
reference : Mosciano, Gerard P&F 21, No. 1, 33, (1996)³
synonyms :
ortho-(ethoxycarbonyl) phenol
 ethyl 2-hydroxybenzoate
 ethyl ortho-hydroxybenzoate
 ethyl salicylate
2-hydroxybenzoic acid ethyl ester
 mesotol
 sal ethyl
 salicylic acid ethyl ester
 salicylic ether
 salicylic ethyl ester
soluble in :
 alcohol
 fixed oils
 water, 737 mg/L 2 25C
insoluble in :
 water
stability :
 non-discoloring in most media
(odor and/or flavor) blends with :
 allyl salicylate
 amyl isoeugenol
para-anisaldehyde
 berry pentadienoate
 birch oil sweet america
isobutyl propionate
isobutyraldehyde
 cananga fruit oil
 cananga leaf oil
 cananga oil
 cananga oil china
 cardamom absolute
 cinnamyl acetate
(E)-cinnamyl acetate
 citronellyl acetone
 clary sage absolute
 cuminaldehyde
 cyclohexyl crotonate
 cyclohexyl propanol
 cyclohexyl salicylate
 dihydrocarveol
 dihydrogeranyl linalool
 earthy indane
 elder flowers absolute
 ethyl anthranilate
 ethyl benzoate
 ethyl isovalerate
isoeugenyl ethyl acetal
 floral methanol
 floral undecenone
 heliotropyl diethyl acetal
(Z)-3-hexen-1-yl benzoate
beta-ionol
(Z)-jasmone
 marigold pot absolute
 methyl 2-methyl butyrate
 methyl benzoate
4-methyl biphenyl
 methyl salicylate
 nonyl benzoate
 oakmoss absolute
3-phenyl propyl propionate
1-phenyl-1-propanol
4-phenyl-3-buten-2-ol
(Z,E)-phytol
 rose oil
 salicyl aldehyde
 tuberose absolute
 tuberose absolute concrete
 wintergreen oil
 ylang ylang absolute
 ylang ylang oil
(odor and/or flavor) used in :
 apricot
 berry
 blackberry
 cassie acacia farnesiana
 cranberry
 floral
 fruit
 grenadine
 lily
 meadowsweet spiraea
 melon watermelon muskmelon cantaloupe
 papaya
 raspberry
 rootbeer
 spirea
 strawberry
 wintergreen
 ylang ylang cananga
natural occurrence in :
capsicum frutescens
data pagecassie absolute @ 0.18%
feijoa fruit
grape
data pagemangrove bark red oil cuba @ 0.10%
data pageosmanthus absolute @ trace%
papaya
raspberry
rum
tomato
whiskey scotch whiskey



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