(E,E)-farnesyl acetate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl] acetate
InChI :InChI=1/C17H28O2/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-19-17(5)18/h8,10,12H,6-7,9,11,13H2,1-5H3/b15-10+,16-12+
InChIKey :ZGIGZINMAOQWLX-NCZFFCEIBR
SMILES :CC(=CCC/C(=C/CC/C(=C/COC(=O)C)/C)/C)C
cas number :4128-17-0
molar refractivity :82.28 ± 0.3 cm3
parachor :683.4 ± 4.0 cm3
index of refraction :1.473 ± 0.02
surface tension :29.6 ± 3.0 dyne/cm
density :0.902 ± 0.06 g/cm3
polarizability :32.61 ± 0.5 10-24cm3
xlogp : 3.80
molecular weight : 264.4030200
formula :C17 H28 O2
BioActivity Analysis :8062930
 
 
export tariff code :2915.39.4550
fda reg :unspecified
 
 

organoleptics :
odor strength :low
odor description :
at 100.00 %.  
oily wax

properties :
appearence :colorless to pale yellow clear liquid
assay : 95.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.91400 @ 25.00 °C.
refractive index :1.47700 @ 20.00 °C.
boiling point : 346.00 - 347.00 °C. @ 760.00 mm Hg
logp : 6.14

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 218.00  °F.  TCC  ( 103.33 °C. )
  
recommendation for (E,E)-farnesyl acetate usage levels up to :
  6.0000 % in the fragrance concentrate.
  

safety links :
chemidplus :004128170
epa-srs :4128-17-0
  

other :
 

references :
pubchem :714516
NIST Chemistry WebBook :1334552525
  
synonyms :
(2E,6E)-farnesyl acetate
(E,E)-farnesyl acetate
2-(E)-6-(E)-farnesyl acetate
trans,trans-farnesyl acetate
(E,E)-3,7,11-trimethyl-2,6,10-dodecatrien-1-ol acetate
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
 citronellyl nitrile
 citronellyl oxyacetaldehyde
 cyclohexyl ethyl alcohol
9-decen-1-al
 ethyl laurate
 heptyl formate
 hexadecanol
 hexyl 2-furoate
 mandarine undecenal
 methyl citronellate
 methyl heptanoate
(Z)-nerolidol
3-nonanon-1-yl acetate
 phenethyl hexanoate
(Z)-8-undecen-1-al
10-undecen-1-ol
 waxy aldehyde
natural occurrence in :
data pageambrette seed concrete @ 30.90%
data pagecerastium candidissimum corr. oil greece @ trace%
data pagecouroupita guianensis aubl. flower oil brazil @ 0.10%
data pagecymbopogon citratus (dc.) stapf. oil cuba @ 0.30%
data pagejasmin sambac absolute egypt @ 0.50%
data pagelime oil expressed florida @ trace%
data pagepalmarosa oil @ 0.10%
data pageskimmia laureola oil @ 1.5%
data pageylang ylang oil @ 0.61%



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Html Last modified 10/29/2008