phenethyl furoate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :2-phenylethyl furan-2-carboxylate
InChI :InChI=1/C13H12O3/c14-13(12-7-4-9-15-12)16-10-8-11-5-2-1-3-6-11/h1-7,9H,8,10H2
InChIKey :QKPSYARWSBJEDY-UHFFFAOYAG
SMILES :C1=CC=C(C=C1)CCOC(=O)C2=CC=CO2
cas number :7149-32-8
fema number :2865
coe number :362
jecfa number :1517
fl. number :13.006
molar refractivity :59.44 ± 0.3 cm3
parachor :478.0 ± 4.0 cm3
index of refraction :1.547 ± 0.02
surface tension :42.4 ± 3.0 dyne/cm
density :1.154 ± 0.06 g/cm3
polarizability :23.56 ± 0.5 10-24cm3
xlogp : 2.50
molecular weight : 216.2325800
formula :C13 H12 O3
 
 
export tariff code :2918.99.2090
fda reg :unspecified
 

Suppliers :
Bedoukian Research :PHENYLETHYL 2-FUROATE
 ≥99.0%, Kosher
 
Sigma-Aldrich-SAFC :Phenethyl 2-furoate
 ≥98%, Kosher
 
 

organoleptics :
odor type :honey
odor strength :medium
odor description :
at 100.00 %.  
honey rose musty mushroom

properties :
appearence :pale yellow to yellow orange clear liquid
assay : 98.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.13800 - 1.14800 @ 25.00 °C.
pounds per gallon - calc. : 9.469 to 9.553
refractive index :1.54000 - 1.55000 @ 20.00 °C.
boiling point : 169.00 °C. @ 30.00 mm Hg
boiling point : 275.00 °C. @ 760.00 mm Hg
acid value : 5.00  max.  KOH/g
logp : 3.01

safety :
Oral Toxicity(LD50) : Oral-Rat    216.00  mg/kg    
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 230.00  °F.  TCC  ( 110.00 °C. )
  
recommendation for phenethyl furoate usage levels up to :
  2.0000 % in the fragrance concentrate.
  
recommendation for phenethyl furoate usage levels up to :
  20.0000 ppm in the flavor.
  

safety links :
rtecs :LQ9400000 for 7149-32-8
chemidplus :007149328
epa-srs :7149-32-8
dtp/nci :72034
  

other :
 

references :
jecfa number :1517
fl. number :13.006
pubchem :204136
NIST Chemistry WebBook :3190322586
  
synonyms :
2-furan carboxylic acid 2-phenyl ethyl ester
 phenethyl 2-furoate
 phenethyl furoate
2-phenyl ethyl 2-furan carboxylate
2-phenyl ethyl 2-furoate
 phenyl ethyl furoate
beta-phenyl ethyl furoate
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
1-acetyl cyclohexyl acetate
 allyl phenoxyacetate
 allyl phenyl acetate
isoamyl phenyl acetate
isoamyl undecylenate
para-anisyl phenyl acetate
 beeswax absolute
 benzyl alcohol
 bran absolute
 butyl benzyl ether
 butyl phenyl acetate
 cardamom absolute
 carnation absolute
 chamomile flower oil germany
 cistus cyclohexanone
 citronellyl isovalerate
 citronellyl oxyacetaldehyde
 citronellyl phenyl acetate
 citronellyl propionate
 citronellyl valerate
 cocoa butenal
 cocoa pentenal
para-cresyl phenyl acetate
 cyclohexyl acetic acid
(E)-alpha-damascone
(E)-beta-damascone
(Z)-alpha-damascone
(Z)-beta-damascone
beta-damascone
gamma-damascone
isodecanal
(Z)-4-decen-1-yl acetate
 decyl formate
 dihydrocarvyl acetate
 dimethyl octanyl acetate
2,4-dimethyl-2-pentenoic acid
 dodecanol
 ethyl hydrocinnamate
 ethyl phenyl acetate
 eugenyl phenyl acetate
isoeugenyl phenyl acetate
 farnesyl acetate
 fig leaf absolute
 floral pyran
 geranyl acetate
 geranyl anthranilate
(E)-geranyl linalool
 geranyl phenyl acetate
 globulol
 guaiacyl phenyl acetate
 hawthorn ethanol
(E)-2-hexen-1-yl phenyl acetate
(E)-3-hexenoic acid
 honeysuckle absolute
 hyacinth acetal
 immortelle absolute
 kewda absolute
 kewda oil
 linalyl phenyl acetate
 methyl (E)-2-hexenoate
 methyl butyl phenyl acetate
 methyl hydrocinnamate
2-methyl octanal
 methyl phenyl acetate
tris(methyl thio) methane
4-methyl-4-phenyl pentanone
 musk acetate
 neryl acetate
 neryl isovalerate
(Z,Z)-3,6-nonadien-1-ol
 nonanal diethyl acetal
 nonanol
(Z)-6-nonen-1-ol
(Z)-3-octen-1-yl propionate
 octyl isovalerate
 orangeflower absolute
 osmanthus absolute
2-pentyl-1-buten-3-one
 phenethyl acetate
 phenethyl anthranilate
 phenethyl benzoate
 phenethyl hexanoate
 phenethyl phenyl acetate
 phenethyl propionate
 phenethyl salicylate
 phenyl acetaldehyde
 phenyl acetaldehyde digeranyl acetal
 phenyl acetic acid
 phenyl glycol diacetate
2-phenyl propyl alcohol
3-phenyl propyl formate
 phenyl pyruvic acid
(E)-2-phenyl-1(2)-propene-1-yl acetate
isopropyl anthranilate
 propyl phenyl acetate
isopropyl phenyl acetate
 rhodinyl phenyl acetate
 rose absolute morocco
 rose carboxylate
laevo-rose oxide
 santalyl phenyl acetate
 strawberry glycidate 1
 strawberry glycidate 2
 styralyl propionate
1,2,3,4-tetrahydroquinoline
 tuberose absolute
 tuberose absolute concrete
(E)-2-undecen-1-ol
2-undecen-1-ol
 wallflower absolute
 waxy acetate
(odor and/or flavor) used in :
 chocolate cocoa
 honey miel
 rose
natural occurrence in :
not found in nature



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