thyme undecane
Notes :
Blends well with green and minty notes. Gives depth and diffusion to aldehydic, floral, chypre and leather. Adds freshness to agrumen and citrus notes.
 
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IUPAC name :3,3-dimethyl-1,5-dioxaspiro[5.5]undecane
InChI :InChI=1/C11H20O2/c1-10(2)8-12-11(13-9-10)6-4-3-5-7-11/h3-9H2,1-2H3
InChIKey :QIFSGRPJUXQGMD-UHFFFAOYAR
SMILES :CC1(COC2(CCCCC2)OC1)C
(EINECS) number :211-898-0
cas number :707-29-9
molar refractivity :52.38 ± 0.4 cm3
parachor :444.8 ± 6.0 cm3
index of refraction :1.474 ± 0.03
surface tension :32.5 ± 5.0 dyne/cm
density :0.98 ± 0.1 g/cm3
polarizability :20.76 ± 0.5 10-24cm3
xlogp : 2.60
molecular weight : 184.2753000
formula :C11 H20 O2
BioActivity Analysis :72970
 
 
fda reg :unspecified h. number :2932.99.0000
 
organoleptics : 
odor type :herbal
odor strength :high ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
fresh thyme leather sweet
substantivity :16  Hour(s)
properties : 
appearence :colorless to pale yellow clear liquid
assay : 98.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.98100 - 0.98400 @ 20.00 °C.
pounds per gallon - calc. : 8.172 to 8.197
refractive index :1.46100 - 1.46400 @ 20.00 °C.
boiling point : 213.00 - 214.00 °C. @ 760.00 mm Hg
logp : 2.67
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 194.00  °F.  TCC  ( 90.00 °C. )
  
recommendation for thyme undecane usage levels up to :
  5.0000 % in the fragrance concentrate.
  
recommendation for thyme undecane usage levels up to :
 not for flavor use.
  
safety links : 
(EINECS) number :211-898-0
chemidplus :000707299
epa-srs :707-29-9
dtp/nci :7021
  
other : 
 
references : 
pubchem :211902
  
synonyms :
3,3-dimethyl-1,5-dioxaspiro(5.5)undecane
3,3-dimethyl-1,5-dioxaspiroundecane
 thyme undecane
 thymoxane
soluble in :
 alcohol
insoluble in :
 water
stability :
 antiperspirant
 bleach
 detergent
 soap
(odor and/or flavor) blends with :
 armoise oil
 green and minty notes
 lavender absolute
 patchouli oil
 sage oil
(odor and/or flavor) used in :
 aldehydic
 citrus
 fresh
 herbal
 leather
 lifter
 patchouli
 sage
 thyme
natural occurrence in :
not found in nature



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Html Last modified 09/27/2008