phenyl salicylate
 
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IUPAC name :phenyl 2-hydroxybenzoate
InChI :InChI=1/C13H10O3/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h1-9,14H
InChIKey :ZQBAKBUEJOMQEX-UHFFFAOYAI
SMILES :C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O
(EINECS) number :204-259-2
cas number :118-55-8
beilstein number :0393969
fema number :3960
coe number :11814
jecfa number :736
fl. number :09.689
molar refractivity :59.77 ± 0.3 cm3
parachor :459.6 ± 4.0 cm3
index of refraction :1.615 ± 0.02
surface tension :51.8 ± 3.0 dyne/cm
density :1.250 ± 0.06 g/cm3
polarizability :23.69 ± 0.5 10-24cm3
xlogp : 4.10
molecular weight : 214.2167000
formula :C13 H10 O3
BioActivity Analysis :91558
 
 
export tariff code :2918.23.0000
fda reg :unspecified
 

Suppliers :
Fleurchem :phenyl salicylate
 
Sigma-Aldrich-SAFC :Phenyl salicylate
 ≥99%
 
 

organoleptics :
odor type :balsamic
odor strength :medium
odor description :
at 100.00 %.  
mild sweet fruity balsam

properties :
appearence :colorless crystalline solid
assay : 99.00 - 100.00 %   
Food Chemicals Codex Listed :No
melting point : 43.00 - 46.00 °C. @ 760.00 mm Hg
boiling point : 172.00 - 173.00 °C. @ 12.00 mm Hg
boiling point : 304.00 - 306.00 °C. @ 760.00 mm Hg
acid value : 1.00  max.  KOH/g
logp : 3.55

safety :
Oral Toxicity(LD50) : Oral-Rat    3.00  gm/kg    
Dermal Toxicity(LD50) : Not determined
Maximised Survey-derived Daily Intakes (MSDI-EU) :7.30 (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :8.00 (μg/capita/day)
  
flash point ( Deg. F. ) :> 212.00  °F.  TCC  ( > 100.00 °C. )
  
recommendation for phenyl salicylate usage levels up to :
 not for fragrance use.
  

safety links :
(EINECS) number :204-259-2
rtecs :VO6125000 for 118-55-8
chemidplus :000118558
epa-srs :118-55-8
dtp/nci :33406
  

other :
 

references :
jecfa number :736
fl. number :09.689
pubchem :151507
NIST Chemistry WebBook :3736686450
  
synonyms :
2-hydroxybenzoic acid phenyl ester
 phenol salicylate
2-phenoxycarbonyl phenol
 phenyl 2-hydroxybenzoate
 phenyl-alpha-hydroxybenzoate
 phenyl salicylate
 salicylic acid phenyl ester
 salol
 salphenyl
soluble in :
 alcohol
 water, 150 mg/L @ 25C
insoluble in :
 water
(odor and/or flavor) blends with :
alpha-amyl cinnamyl acetate
 benzyl acetone
isobutyl cinnamate
 cinnamyl anthranilate
 cinnamyl butyrate
(E)-cinnamyl butyrate
 cinnamyl formate
 cinnamyl propionate
 ethyl cinnamate
 hexyl cinnamate
 octyl benzoate
3-phenyl propyl isobutyrate
 prenyl benzoate
 propyl 2-furan acrylate
 santalyl butyrate
 terpinyl butyrate
(odor and/or flavor) used in :
 balsam
 fruit
 herbal
 intensifier
 wintergreen
natural occurrence in :
not found in nature



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