(Z)-4-hepten-1-al diethyl acetal
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :(Z)-7,7-diethoxyhept-3-ene
InChI :InChI=1/C11H22O2/c1-4-7-8-9-10-11(12-5-2)13-6-3/h7-8,11H,4-6,9-10H2,1-3H3/b8-7-
InChIKey :BOALWZNGHWYCRG-FPLPWBNLBX
SMILES :CC\C=C/CCC(OCC)OCC
(EINECS) number :242-376-0
cas number :18492-65-4
fema number :3349
coe number :10011
jecfa number :949
fl. number :06.037
molar refractivity :56.51 ± 0.3 cm3
parachor :493.7 ± 4.0 cm3
index of refraction :1.434 ± 0.02
surface tension :26.8 ± 3.0 dyne/cm
density :0.859 ± 0.06 g/cm3
polarizability :22.40 ± 0.5 10-24cm3
xlogp : 3.40
molecular weight : 186.2911800
formula :C11 H22 O2
 
 
IUPAC name :(E)-7,7-diethoxyhept-3-ene
InChI :InChI=1/C11H22O2/c1-4-7-8-9-10-11(12-5-2)13-6-3/h7-8,11H,4-6,9-10H2,1-3H3/b8-7+
InChIKey :BOALWZNGHWYCRG-BQYQJAHWBR
SMILES :CC\C=C\CCC(OCC)OCC
cas number :18492-66-5
molar refractivity :56.51 ± 0.3 cm3
parachor :493.7 ± 4.0 cm3
index of refraction :1.434 ± 0.02
surface tension :26.8 ± 3.0 dyne/cm
density :0.859 ± 0.06 g/cm3
polarizability :22.40 ± 0.5 10-24cm3
xlogp : 3.40
molecular weight : 186.2911800
formula :C11 H22 O2
 
 
fda reg :unspecified h. number :2911.00.5000
organoleptics : 
odor type :green
odor strength :medium
odor description :
at 100.00 %.  
fatty creamy
taste description³ :at 20.00 ppm.  
Green, dairy-like, creamy, apple, vagetable and strawberry
properties : 
appearence :colorless clear liquid
assay : 97.00 - 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.84400 - 0.85400 @ 25.00 °C.
pounds per gallon - calc. : 7.023 to 7.106
refractive index :1.42200 - 1.43200 @ 20.00 °C.
boiling point : 93.00 °C. @ 15.00 mm Hg
logp : 3.53
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 160.00  °F.  TCC  ( 71.11 °C. )
  
recommendation for (Z)-4-hepten-1-al diethyl acetal usage levels up to :
  0.5000 % in the fragrance concentrate.
  
recommendation for (Z)-4-hepten-1-al diethyl acetal usage levels up to :
  1.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :242-376-0
chemidplus :018492654
epa-srs :18492-65-4
  
chemidplus :018492665
epa-srs :18492-66-5
  
other : 
 
references : 
pubchem :664500
  
pubchem :664501
  
reference : Mosciano, Gerard P&F 16, No. 4, 45, (1991)³
synonyms :
(Z)-7,7-diethoxyhept-3-ene
cis-7,7-diethoxyhept-3-ene
1,1-diethoxyhept-4-ene
(Z)-4-hepten-1-al diethyl acetal
cis-4-hepten-1-al diethyl acetal
(Z)-4-heptenal diethyl acetal
cis-4-heptenal diethyl acetal
soluble in :
 alcohol
 water, slightly
insoluble in :
 water
stability :
 alkalis
(odor and/or flavor) used in :
 butterscotch
 cookie
 cream
 fat
 toffee
 vanilla
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