methyl salicylate
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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
cas number :119-36-8
(EINECS) number :204-317-7
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 (IUPAC)
formula :C8 H8 O3
BioActivity Analysis :73900
NMR Predictor :Predict
 
 
export tariff code :2918.23.0000
fda reg :175.105
177.1010

Suppliers :
Advanced Biotech :methyl salicylate
99% min. natural
Advanced Biotech :methyl salicylate
99% min. synthetic
Berje :Methyl Salicylate
Citrus and Allied Essences :methyl salicylate
98% (natural)
Fleurchem :methyl salicylate
natural
Fleurchem :methyl salicylate
John D. Walsh :Methyl Salicylate
Moellhausen :methyl salicylate
98% min. nature identical kosher
Odor:  aromatic, sweet, curative, phenolic
Flavor:  sweet, wintergreen
Penta :methyl salicylate
Penta :methyl salicylate
98% (natural)
Polarome :METHYL SALICYLATE
SYNTHETIC NF/FCC
Robertet :Methyl salicylate
naturel
Sigma-Aldrich-SAFC :Methyl salicylate
≥98%, FCC, Kosher
Odor:  minty; spicy; sweet
Ungerer :Methyl Salicylate
Vigon :Methyl Salicylate Extra Pure
Vigon :Methyl Salicylate

organoleptics :
odor type :minty
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :¹
at 10.00 % in dipropylene glycol.  
wintergreen mint
odor sample from :Berje Inc.
substantivity :8  Hour(s)

properties :
appearence :colorless to pink clear liquid
assay : 99.00 to 100.00 %   
Food Chemicals Codex Listed :Yes
specific gravity :1.18000 to 1.18500 @ 25.00 °C.
pounds per gallon - calc. : 9.819 to 9.860
refractive index :1.53500 to 1.53800 @ 20.00 °C.
melting point : -8.00 to -7.00 °C. @ 760.00 mm Hg
boiling point : 222.00 to 224.00 °C. @ 760.00 mm Hg
boiling point : 132.00 to 133.00 °C. @ 50.00 mm Hg
acid value : 1.00  max.  KOH/g
vapor pressure :1.00000 mm/Hg @ 54.00 °C.
vapor density :5.26 ( Air = 1 )
flash point : 205.00  °F.  TCC  ( 96.11 °C. )
logP (o/w) : 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.
  R 22 - Harmful if swallowed.
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 37/39 - Wear suitable gloves and eye/face protection.
Human experience : 8 % solution: no irritation or sensitization.
Oral Toxicity(LD50) :
  Gavage-Mouse   [sex: M]  1390.00  mg/kg
(Ohsumi et al., 1984)

Gavage-Rat    1250.00  mg/kg
(Giroux et al., 1954b)

Oral-Rat   [sex: M,F]  M:3049.00 F:2642.00  mg/kg
(Givaudan Corporation, 1982)

Gavage-Rat   [sex: M,F]  887.00  mg/kg
(Jenner et al., 1964)

Oral-Rat    1220.00  mg/kg
(Nivikov et al., 1994)

Oral-Mouse   [sex: M]  1110.00  mg/kg
(Davison et al., 1961)

Gavage-Guineapig   [sex: M,F]  1060.00  mg/kg
(Jenner et al., 1964)

Gavage-Mouse   [sex: M,F]  1440.00  mg/kg
(NTP, 1984a)

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

safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :410.00 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :44000.00 (μg/capita/day)
 
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 references :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
msds :msds
EPI System :view
NIOSH International Chemical Safety Cards :search
NLM Hazardous Substances Data Bank :search
Chemical Carcinogenesis Research Information System :Search
AIDS Citations :Search
Cancer Citations :Search
Toxicology Citations :Search
Env. Mutagen Info. Center :Search
NLM Developmental and Reproductive Toxicity :Search
National Toxicology Program :Search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
WISER :UN 3082
 
WGK Germany :1
 
 
 
 methyl 2-hydroxybenzoate
(EINECS) number :204-317-7
RTECS :119-36-8
chemidplus :000119368
EPA Substance Registry Services :119-36-8
dtp/nci :8204

references :
 methyl 2-hydroxybenzoate
fl. number :09.749
jecfa number :899
NIST Chemistry WebBook :2953080148
pubchem :151540

Cosmetics :
Cosmetic uses : denaturants
masking agents
perfuming agents
soothing agents

other :
reference : Luebke, William tgsc, (1983)¹
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
 C of A
Household Products : Search
synonyms :
2-carbomethoxyphenol
2-hydroxybenzoic acid methyl ester
ortho-hydroxybenzoic acid methyl ester
2-(methoxycarbonyl) phenol
 methyl 2-hydroxybenzoate
 methyl ortho-hydroxybenzoate
 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 :
2-acetoxy-1,8-cineole
 agathosma crenulata oil
isoamyl benzoate
alpha-amyl cinnamaldehyde
isoamyl salicylate
para-anisaldehyde
 armoise oil
 artemisyl ketone
 basil oleoresin sweet
 bay leaf oil
 benzyl acetate
 benzyl isoeugenol
 benzyl mercaptan
 benzyl propionate
 benzyl salicylate
3-benzyl-4-heptanone
 bois de rose oil
isobornyl acetate
laevo-bornyl acetate
isobornyl formate
 buchu leaf oil
 buchu mercaptan
para-tert-butyl cyclohexanone
isobutyl salicylate
isobutyraldehyde
 camel grass oil
 camphene hydrate
dextro-camphor
 camphor oil
 caraway seed oil
laevo-carveol
 carvone
laevo-carvone
(Z)-carvone-5,6-oxide
 carvyl propionate
 cassia bark oil
1,4-cineole
 cinnamon bark oil
 cinnamyl alcohol
 citronellal diisotridecyl acetal
 clove bud oil
 coriander seed oil
 cornmint oil
 cornmint oil india
 cornmint oil terpeneless
 costmary oil
 coumarin
 cyclamen aldehyde
beta-cyclocitral
 cyclohexanone
2-cyclohexyl cyclohexanone
 cyclohexyl ethyl acetate
 cyclohexyl propanol
 cyclopentanone
2-cyclopentyl cyclopentanone
gamma-decalactone
2-decalinol
 decanol
 dehydroxylinalool oxide
 diethyl malonate
N,N-diethyl octanamide
 dihydroanethol
 dihydrocarveol
 dihydrocarvyl acetate
isodihydrolavandulol
isodihydrolavandulyl acetate
2',4'-dimethyl acetophenone
2-(1,1-dimethyl ethyl)-4-methyl cyclohexanol
(±)-N,N-dimethyl menthyl succinamide
 diosphenol
 dodecanal
 dodecanol
 earthy indane
 estragole
 ethyl heptanoate
 ethyl maltol
 ethyl salicylate
 ethyl vanillin
 eucarvone
 eugenol
 floral methanol
 foeniculum vulgare piperitum oil
 geraniol
 geranium absolute
 geranium oil china
 grapefruit menthane
 green acetate
 gurjun balsam oil
 heliotropin
 herbal ethanone
 herbal undecanol
(Z)-3-hexen-1-yl acetate
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
 ho leaf oil
 hydroxycitronellal
 hyssop oil
 leaf acetal
 lilac lactone
 limonen-10-yl acetate
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
 lippia alnifolia schau. leaf oil brazil
 mentha longifolia (l.) huds. oil jordan
(E)-para-mentha-2,8-dien-1-ol
dextro-2,8-para-menthadien-1-ol
(Z+E)-para-1(7)8-menthadien-2-yl acetate
 menthadienyl formate
(E)-para-menthan-2-one
para-menthane-3,8-diol
 menthol
dextro-neomenthol
dextro,laevo-menthol
homomenthol
laevo-menthol
isomenthone
laevo-menthone
3-laevo-menthoxy-2-methyl propane-1,2-diol
 menthoxypropane diol
 menthyl acetate
dextro,laevo-menthyl acetate
homomenthyl acetate
laevo-menthyl acetate
laevo-monomenthyl glutarate
laevo-menthyl methyl ether
 menthyl methyl lactate
 menthyl propylene glycol carbonate
2-methyl 3-(methyl thio) furan 10% in triacetin
4-methyl biphenyl
alpha-methyl cinnamaldehyde
 methyl cinnamate
2-methyl cyclohexanone
 muguet butanol
 myrtenol
 nonyl benzoate
 nopyl acetate
 ocean propanal
 ocimene quintoxide
3-octanol
3-octyl acetate
 orange oil
 patchouli ethanol
 patchouli ethanone
 patchouli hexanol
 pennyroyal oil
 pennyroyal oil cuba
 pennyroyal oil spain
 pennyroyal oil uruguay
 peppermint cyclohexanone
 peppermint oil
 peppermint oil CO2 extract
 peppermint oil mongolia
 peppermint oil russia
 peppermint oil terpeneless america
 perillaldehyde
laevo-perillaldehyde
beta-phellandrene
 phenethyl acetate
 phenethyl salicylate
3-phenyl propyl alcohol
(Z,Z)-photocitral A
(Z)-2-pinanol
 pine hexanol
(+)-alpha-pinene
 pinocarvone
 piperitenone
 piperitenone oxide
 piperitone
dextro-piperitone
laevo-piperitone
 plectranthus glandulosus hook f. leaf oil cameroon
isopropyl pyrazine
isopropyl tiglate
isopulegol
 pulegone
isopulegone
isopulegyl acetate
isopulegyl formate
 raspberry ketone methyl ether
 rose butanoate
 rosemary absolute
 rosemary oil morocco
 sabinene hydrate
 santall
 satureja viminea l. oil costa rica
 spearmint absolute
 spearmint oil
 spearmint oil terpeneless
 tansy flower oil canada
 tansy flower oil dutch
 tansy oil
alpha-terpineol
 tetrahydrocarvone
 tetrahydrolinalool
 thiogeraniol
 thujyl alcohol
 trimethyl isopropyl butanamide
 umbellulone
gamma-undecalactone
 vanilla absolute
 vanillin menthoxypropane diol acetal
 vanillyl acetate
laevo-verbenone
 viridiflorol
 wintergreen oil
 woody amylene
 WS-5
 ylang ylang oil III

(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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