(Z)-sabinyl acetate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :[(1S,3R,5S)-4-methylidene-1-propan-2-yl-3-bicyclo[3.1.0]hexanyl] acetate
InChI :InChI=1/C12H18O2/c1-7(2)12-5-10(12)8(3)11(6-12)14-9(4)13/h7,10-11H,3,5-6H2,1-2,4H3/t10-,11-,12+/m1/s1
InChIKey :PBWRFXQNNGSAQG-UTUOFQBUBS
SMILES :CC(C)[C@@]12C[C@@H]1C(=C)[C@@H](C2)OC(=O)C
cas number :53833-85-5
molar refractivity :54.85 ± 0.4 cm3
parachor :452.7 ± 6.0 cm3
index of refraction :1.488 ± 0.03
surface tension :32.1 ± 5.0 dyne/cm
density :1.02 ± 0.1 g/cm3
polarizability :21.74 ± 0.5 10-24cm3
xlogp : 2.90
molecular weight : 194.2701200
formula :C12 H18 O2
 
 
export tariff code :2915.39.9050
fda reg :unspecified
 
 

organoleptics :

properties :
appearence :colorless clear liquid
assay : 92.00 - 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 230.00 - 231.00 °C. @ 760.00 mm Hg
logp : 3.13

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 184.00  °F.  TCC  ( 84.44 °C. )
  

safety links :
chemidplus :053833855
epa-srs :53833-85-5
  

other :
 

references :
pubchem :711496
  
synonyms :
(Z)-sabinene hydrate acetate
cis-sabinene hydrate acetate
(Z)-sabinyl acetate
cis-sabinyl acetate
soluble in :
 alcohol
insoluble in :
 water
natural occurrence in :
data pageartemisia deserti krasch. oil iran @ 1.40%
data pagemarjoram oil sweet iran @ 0.50%
data pagesage oil spain @ 0.1-6.6%
data pagesage oil spain @ 12.8%
data pagesavin oil @ 45.50%
data pagewormwood oil america @ 32.75%



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Html Last modified 10/29/2008