methyl salicylate
Notes :
Blend with the benzoates to remove the harshness.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :methyl 2-hydroxybenzoate
InChI :InChI=1/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H3
InChIKey :OSWPMRLSEDHDFF-UHFFFAOYAD
SMILES :COC(=O)C1=CC=CC=C1O
(EINECS) number :204-317-7
cas number :119-36-8
beilstein number :0971516
fema number :2745
coe number :433
jecfa number :899
fl. number :09.749
molar refractivity :39.90 ± 0.3 cm3
parachor :327.1 ± 4.0 cm3
index of refraction :1.547 ± 0.02
surface tension :45.7 ± 3.0 dyne/cm
density :1.209 ± 0.06 g/cm3
polarizability :15.82 ± 0.5 10-24cm3
xlogp : 2.50
molecular weight : 152.1473200
formula :C8 H8 O3
BioActivity Analysis :73900
 
 
fda reg :175.105
177.1010
h. number :2918.23.0000
organoleptics : 
odor type :minty
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
wintergreen mint
taste description³ :at 10.00 ppm.  
Sweet, salicylate and root beer with aromatic and balsamic nuances
substantivity :8  Hour(s)
properties : 
appearence :colorless to pink clear liquid
assay : 99.00 - 100.00 %   
Food Chemicals Codex Listed :Yes
specific gravity :1.18000 - 1.18500 @ 25.00 °C.
pounds per gallon - calc. : 9.819 to 9.860
refractive index :1.53500 - 1.53800 @ 20.00 °C.
melting point : -8.00 - -7.00 °C. @ 760.00 mm Hg
boiling point : 222.00 - 224.00 °C. @ 760.00 mm Hg
boiling point : 132.00 - 133.00 °C. @ 50.00 mm Hg
acid value : 1.00  max.  KOH/g
logp : 2.55
shelf life : 24.00 month(s) or longer if stored properly.
storage :store in cool, dry place in tightly sealed containers, protected from heat and light.
safety : 
most important hazard(s) : Xn - Harmful.
  
Oral Toxicity(LD50) : Oral-Rat    1300.00  mg/kg  FCTXAV  16,821,1978
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 205.00  °F.  TCC  ( 96.11 °C. )
  
recommendation for methyl salicylate usage levels up to :
  10.0000 % in the fragrance concentrate.
  
recommendation for methyl salicylate usage levels up to :
  8400.0000 ppm in the flavor.
  
safety links : 
msds :msds
  
(EINECS) number :204-317-7
rtecs :VO4725000 for 119-36-8
chemidplus :000119368
epa-srs :119-36-8
dtp/nci :8204
  
other : 
  C of A
references : 
pubchem :151540
NIST Chemistry WebBook :2953080148
  
reference : Mosciano, Gerard P&F 20, No. 6, 49, (1995)³
synonyms :
2-carbomethoxyphenol
2-hydroxybenzoic acid methyl ester
ortho-hydroxybenzoic acid methyl ester
2-(methoxycarbonyl) phenol
 methyl 2-hydroxybenzoate
 methyl ortho-hydroxybenzoate
 methyl salicylate
 salicylic acid methyl ester
 synthetic sweet birch oil
 synthetic teaberry oil
 synthetic wintergreen oil
soluble in :
 alcohol
 dipropylene glycol
 kerosene
 paraffin oil
 water, 700 mg/L @ 30C
insoluble in :
 water
stability :
 non-discoloring in most media
(odor and/or flavor) blends with :
isoamyl benzoate
alpha-amyl cinnamaldehyde
isoamyl salicylate
para-anisaldehyde
 bay leaf oil
 benzyl acetate
 benzyl isoeugenol
 benzyl propionate
 benzyl salicylate
 bois de rose oil
isobornyl acetate
laevo-bornyl acetate
isobutyl salicylate
 caraway seed oil
laevo-carvone
 cassia bark oil
 cinnamon bark oil
 cinnamyl alcohol
 clove bud oil
 coriander seed oil
 coumarin
 cyclamen aldehyde
gamma-decalactone
 decanol
 diethyl malonate
 dihydroanethol
 dodecanal
 dodecanol
 ethyl heptanoate
 ethyl maltol
 ethyl vanillin
 eugenol
 geraniol
 green acetate
 gurjun balsam oil
 heliotropin
(Z)-3-hexen-1-yl acetate
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
 ho leaf oil
 hydroxycitronellal
 leaf acetal
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
dextro,laevo-menthol
alpha-methyl cinnamaldehyde
 methyl cinnamate
 musks
 nopyl acetate
 ocean propanal
 orange oil
 patchouli ethanone
 peppermint oil
 phenethyl acetate
 phenethyl salicylate
3-phenyl propyl alcohol
 raspberry ketone methyl ether
 rose butanoate
 santall
 spearmint oil
alpha-terpineol
 tetrahydrolinalool
gamma-undecalactone
 vanilla absolute
 vanillyl acetate
 woody amylene
(odor and/or flavor) used in :
 alpine bouquet
 apple
 apricot
 birch beer
 blackberry
 blueberry
 boxwoodberry
 bubblegum
 carnation dianthus oeillet
 cassia
 cassia blossom
 cassie acacia farnesiana
 cassis black currant bud
 castoreum
 cherry
 chypre
 clove
 cornmint
 crabapple blossom
 cranberry
 currant
 date
 fern fougere
 gardenia
 gooseberry
 grape
 grenadine
 hay new mown hay foin coupe
 herbal
 huckleberry bilberry
 hyssop
 jasmin
 leather russian leather
 licorice
 magnolia
 meadowsweet spiraea
 mimosa wattle
 mint
 mulberry
 oriental
 peach
 peppermint
 raspberry
 reseda mignonette
 rootbeer
 rue
 sarsaparilla
 sassafras
 spearmint
 spice
 spicewood
 strawberry
 tea green tea
 tomato
 tuberose tubereuse
 tutti frutti
 wallflower giroflee
 wintergreen
 wormwood absinthium
 ylang ylang cananga
 zibeline
natural occurrence in :
bilberry
data pagecassie absolute @ 94.40%
data pagechampaca absolute (michelia alba dc.) @ 0.02%
data pagechampaca concrete @ 0.15%
data pagecouroupita guianensis aubl. flower oil brazil @ 0.50%
currant black currant
data pagedialium guineense wild.fruit oil france @ 4.90%
grape concord grape
data pagelaurel leaf oil turkey @ trace%
data pageorthodon dianthera maxim. oil vietnam @ trace%
peach
data pagepetitgrain mandarin oil @ trace%
data pagepimento berry oil @ trace%
rue oil
data pagestachys recta l. oil serbia @ 0.20%
strawberry
tomato
wintergreen
data pageylang ylang oil @ 0.29%
data pageylang ylang oil CO2 extract @ 0.04%



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