strawberry glycidate 2
Notes :
Better than the aldehyde C-16.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :ethyl 3-phenyloxirane-2-carboxylate
InChI :InChI=1/C11H12O3/c1-2-13-11(12)10-9(14-10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3
InChIKey :GOMAKLPNAAZVCJ-UHFFFAOYAL
SMILES :CCOC(=O)C1C(O1)C2=CC=CC=C2
(EINECS) number :204-467-3
cas number :121-39-1
beilstein number :0163394
fema number :2454
coe number :11844
jecfa number :1576
fl. number :16.018
molar refractivity :50.85 ± 0.3 cm3
parachor :416.2 ± 6.0 cm3
index of refraction :1.538 ± 0.02
surface tension :42.9 ± 3.0 dyne/cm
density :1.182 ± 0.06 g/cm3
polarizability :20.16 ± 0.5 10-24cm3
xlogp : 1.90
molecular weight : 192.2111800
formula :C11 H12 O3
BioActivity Analysis :74513
 
 
IUPAC name :ethyl (2R,3R)-3-phenyloxirane-2-carboxylate
InChI :InChI=1/C11H12O3/c1-2-13-11(12)10-9(14-10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3/t9-,10-/m1/s1
InChIKey :GOMAKLPNAAZVCJ-NXEZZACHBL
SMILES :CCOC(=O)[C@H]1[C@H](O1)C2=CC=CC=C2
cas number :121-39-1
molar refractivity :50.85 ± 0.3 cm3
parachor :416.2 ± 6.0 cm3
index of refraction :1.538 ± 0.02
surface tension :42.9 ± 3.0 dyne/cm
density :1.182 ± 0.06 g/cm3
polarizability :20.16 ± 0.5 10-24cm3
xlogp : 1.90
molecular weight : 192.2111800
formula :C11 H12 O3
 
 
IUPAC name :ethyl (2R,3S)-3-phenyloxirane-2-carboxylate
InChI :InChI=1/C11H12O3/c1-2-13-11(12)10-9(14-10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3/t9-,10+/m0/s1
InChIKey :GOMAKLPNAAZVCJ-VHSXEESVBE
SMILES :CCOC(=O)[C@H]1[C@@H](O1)C2=CC=CC=C2
cas number :121-39-1
molar refractivity :50.85 ± 0.3 cm3
parachor :416.2 ± 6.0 cm3
index of refraction :1.538 ± 0.02
surface tension :42.9 ± 3.0 dyne/cm
density :1.182 ± 0.06 g/cm3
polarizability :20.16 ± 0.5 10-24cm3
xlogp : 1.90
molecular weight : 192.2111800
formula :C11 H12 O3
 
 
IUPAC name :ethyl (2S,3R)-3-phenyloxirane-2-carboxylate
InChI :InChI=1/C11H12O3/c1-2-13-11(12)10-9(14-10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3/t9-,10+/m1/s1
InChIKey :GOMAKLPNAAZVCJ-ZJUUUORDBK
SMILES :CCOC(=O)[C@@H]1[C@H](O1)C2=CC=CC=C2
cas number :2272-55-1
molar refractivity :50.85 ± 0.3 cm3
parachor :416.2 ± 6.0 cm3
index of refraction :1.538 ± 0.02
surface tension :42.9 ± 3.0 dyne/cm
density :1.182 ± 0.06 g/cm3
polarizability :20.16 ± 0.5 10-24cm3
xlogp : 1.90
molecular weight : 192.2111800
formula :C11 H12 O3
 
 
IUPAC name :ethyl (2S,3S)-3-phenyloxirane-2-carboxylate
InChI :InChI=1/C11H12O3/c1-2-13-11(12)10-9(14-10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3/t9-,10-/m0/s1
InChIKey :GOMAKLPNAAZVCJ-UWVGGRQHBT
SMILES :CCOC(=O)[C@@H]1[C@@H](O1)C2=CC=CC=C2
cas number :121-39-1
molar refractivity :50.85 ± 0.3 cm3
parachor :416.2 ± 6.0 cm3
index of refraction :1.538 ± 0.02
surface tension :42.9 ± 3.0 dyne/cm
density :1.182 ± 0.06 g/cm3
polarizability :20.16 ± 0.5 10-24cm3
xlogp : 1.90
molecular weight : 192.2111800
formula :C11 H12 O3
 
 
fda reg :172.515 h. number :2915.50.3000
organoleptics : 
odor type :fruity
odor strength :medium
odor description :
at 100.00 %.  
sweet strawberry fresh berry honey floral rose
taste description³ :at 30.00 ppm.  
Sweet, fruity and berry with a dried fruit and floral nuance
substantivity :312  Hour(s)
properties : 
appearence :colorless to pale yellow clear liquid
assay : 97.00 - 100.00 %   sum of isomers
Food Chemicals Codex Listed :Yes
specific gravity :1.11900 - 1.12700 @ 25.00 °C.
pounds per gallon - calc. : 9.311 to 9.378
specific gravity :1.12000 - 1.12800 @ 20.00 °C.
pounds per gallon - calc. : 9.330 to 9.397
refractive index :1.51500 - 1.52000 @ 20.00 °C.
boiling point : 96.00 °C. @ 0.50 mm Hg
acid value : 1.00  max.  KOH/g
logp : 1.89
safety : 
most important hazard(s) : Xn - Harmful.
  
Oral Toxicity(LD50) : Oral-Rat    2300.00  mg/kg  FCTXAV  13,101,1975
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) :> 212.00  °F.  TCC  ( > 100.00 °C. )
  
recommendation for strawberry glycidate 2 usage levels up to :
  10.0000 % in the fragrance concentrate.
  
recommendation for strawberry glycidate 2 usage levels up to :
  70.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :204-467-3
rtecs :MB4970000 for 121-39-1
chemidplus :000121391
epa-srs :121-39-1
dtp/nci :8899
  
chemidplus :121-39-1
epa-srs :121-39-1
  
chemidplus :121-39-1
epa-srs :121-39-1
  
chemidplus :2272-55-1
epa-srs :2272-55-1
dtp/nci :82271
  
chemidplus :121-39-1
epa-srs :121-39-1
  
other : 
 
references : 
pubchem :151627
NIST Chemistry WebBook :1397561291
  
pubchem :35396986
  
pubchem :35396989
  
pubchem :120976
  
pubchem :35396991
  
reference : Mosciano, Gerard P&F 19, No. 3, 51, (1994)³
synonyms :
 ethyl 2,3-epoxy-3-phenyl propionate
 ethyl 3-phenyl glycidate
 ethyl 3-phenyl oxirane carboxylate
 ethyl 3-phenyl oxirane-2-carboxylate
 ethyl alpha,beta-epoxy-beta-phenyl propionate
 ethyl alpha,beta-epoxyhydrocinnamate
 ethyl phenyl glycidate
 ethyl-3-phenyl glycidate
2-ethyl-3-phenyl glycidate
 ethyl-3-phenyl-2,3-epoxypropionate
 glycolic acid 2-phenyl:ethyl ester
3-phenyl glycidic acid ethyl ester
3-phenyl oxirane carboxylic acid ethyl ester
 strawberry glycidate 2
soluble in :
 alcohol
insoluble in :
 water
stability :
 alcoholic lotion
 antiperspirant
 deo stick
 detergent perborate
 fabric softener
 liquid detergent
 shampoo
 soap
(odor and/or flavor) used in :
 banana
 currant
 fruit
 honey miel
 jam
 plum
 strawberry
natural occurrence in :
not found in nature



information only - not sold by The Good Scents Company.



Please share your Information / Comments.

Your email Address:



Top of Page          The Good Scents Company Home

Copyright © 1980-2008 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 06/12/2008