propyl 2-furan acrylate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :propyl (E)-3-furan-2-ylprop-2-enoate
InChI :InChI=1/C10H12O3/c1-2-7-13-10(11)6-5-9-4-3-8-12-9/h3-6,8H,2,7H2,1H3/b6-5+
InChIKey :RRFBKGHLBNBFGL-AATRIKPKBW
SMILES :CCCOC(=O)\C=C\C1=CC=CO1
(EINECS) number :210-780-6
cas number :623-22-3
fema number :2945
coe number :11842
jecfa number :1518
fl. number :13.047
molar refractivity :50.11 ± 0.3 cm3
parachor :408.2 ± 4.0 cm3
index of refraction :1.514 ± 0.02
surface tension :36.4 ± 3.0 dyne/cm
density :1.084 ± 0.06 g/cm3
polarizability :19.86 ± 0.5 10-24cm3
xlogp : 1.70
molecular weight : 180.2004800
formula :C10 H12 O3
 

 
IUPAC name :propyl (Z)-3-furan-2-ylprop-2-enoate
InChI :InChI=1/C10H12O3/c1-2-7-13-10(11)6-5-9-4-3-8-12-9/h3-6,8H,2,7H2,1H3/b6-5-
InChIKey :RRFBKGHLBNBFGL-WAYWQWQTBK
SMILES :CCCOC(=O)\C=C/C1=CC=CO1
(EINECS) number :210-780-6
cas number :623-22-3  (Z)
fema number :2945
coe number :11842
jecfa number :1518
fl. number :13.047
molar refractivity :50.11 ± 0.3 cm3
parachor :408.2 ± 4.0 cm3
index of refraction :1.514 ± 0.02
surface tension :36.4 ± 3.0 dyne/cm
density :1.084 ± 0.06 g/cm3
polarizability :19.86 ± 0.5 10-24cm3
xlogp : 1.70
molecular weight : 180.2004800
formula :C10 H12 O3
 

 
export tariff code :2916.12.6000
fda reg :unspecified
 

Suppliers :
Cargill - Alfrebro :n-PROPYL-2-FURANACRYLATE
Kosher

organoleptics :
odor type :spicy
odor strength :medium ,
recommend smelling in a 1.00 % solution or less
odor description :
at 1.00 % in dipropylene glycol.  
sweet spice fruity caramel

properties :
appearence :colorless to pale yellow clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.07100 to 1.07700 @ 25.00 °C.
pounds per gallon - calc. : 8.912 to 8.962
refractive index :1.52000 to 1.52600 @ 20.00 °C.
boiling point : 119.00 °C. @ 7.00 mm Hg
boiling point : 236.00 °C. @ 760.00 mm Hg
acid value : 5.00  max.  KOH/g
logp : 2.86

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
flash point ( Deg. F. ) : 225.00  °F.  TCC  ( 107.22 °C. )
recommendation for propyl 2-furan acrylate usage levels up to :
  0.5000 % in the fragrance concentrate.
recommendation for propyl 2-furan acrylate usage levels up to :
  25.0000 ppm in the flavor.

safety links :
 
 
(EINECS) number :210-780-6
chemidplus :623-22-3
EPA Substance Registry Services :623-22-3
NLM Chemical Carcinogenesis Research Information System :623-22-3
NLM Developmental and Reproductive Toxicity :623-22-3
NLM Env. Mutagen Info. Center :623-22-3
NLM GENetic TOXicology :623-22-3
EPI System :view

other :

references :
jecfa number :1518
fl. number :13.047
pubchem :43183213
jecfa number :1518
fl. number :13.047
pubchem :197427
synonyms :
2-furan acrylic acid propyl ester
3-(2-furanyl)-2-furan acrylic acid propyl ester
 propyl 2-furan acrylate
 propyl 3-(2-furanyl)-2-propenoate
 propyl 3-(2-furyl) acrylate
 propyl 3-(2-furyl)-2-propenoate
 propyl beta-2-furyl acrylate
 propyl beta-furyl acrylate

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
alpha-amyl cinnamyl acetate
para-anisyl methyl ketone
 bay leaf oil terpeneless
 benzoin absolute sumatra
 benzoin resin sumatra
 benzoin resinoid sumatra
 benzyl acetone
 benzyl formate
 benzyl isoeugenol
 benzyl methyl tiglate
alpha-bisabolene
 butyl benzoate
isobutyl cinnamate
 cadinadiene
 cinnamyl acetate
(E)-cinnamyl acetate
 cinnamyl anthranilate
 cinnamyl benzoate
 cinnamyl butyrate
(E)-cinnamyl butyrate
 cinnamyl formate
 cinnamyl propionate
 copaiba balsam oil
 ethyl cinnamate
 ethyl salicylate
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-one
5-ethyl-3,4,5,6-tetramethyl cyclohexen-2-one
 frankincense absolute
 furfural acetone
 galangal root oleoresin
2-heptanone
 hexyl 3-mercaptobutanoate
 hexyl cinnamate
2-hexylidene cyclopentanone
 lavender absolute
 mace oil CO2 extract
 myrcene
 myrrh resinoid
 nonisyl acetate
 nutmeg absolute
 nutmeg extract CO2 west indian
 octanal diethyl acetal
 octyl benzoate
 opoponax oil
 opoponax resinoid
3-phenyl propyl isobutyrate
 phenyl salicylate
 prenyl benzoate
 rhodinyl isobutyrate
 rose carboxylate
 santalyl butyrate
 spicy acetoacetate
 terpinyl butyrate
 tolu balsam oil
 tonka undecanone
 woody octene

(odor and/or flavor) used in :
 apple
 caramel
 guava
 honey miel
 papaya
 pear
 raspberry
 strawberry
 tangerine

natural occurrence in :
found in nature



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