octyl cinnamate
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :octyl (E)-3-phenylprop-2-enoate
InChI :InChI=1/C17H24O2/c1-2-3-4-5-6-10-15-19-17(18)14-13-16-11-8-7-9-12-16/h7-9,11-14H,2-6,10,15H2,1H3/b14-13+
InChIKey :VIKVSUVYUVJHOA-BUHFOSPRBR
SMILES :CCCCCCCCOC(=O)\C=C\C1=CC=CC=C1
(EINECS) number :273-842-1
cas number :69038-78-4
molar refractivity :80.98 ± 0.3 cm3
parachor :653.2 ± 4.0 cm3
index of refraction :1.520 ± 0.02
surface tension :36.4 ± 3.0 dyne/cm
density :0.979 ± 0.06 g/cm3
polarizability :32.10 ± 0.5 10-24cm3
xlogp : 5.90
molecular weight : 260.3712600
formula :C17 H24 O2
 
 
fda reg :unspecified h. number :unspecified
organoleptics : 
odor type :balsamic
odor strength :medium
odor description :
at 100.00 %.  
balsam cinnamate opoponax
properties : 
appearence :colorless to pale yellow clear liquid
assay : 98.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.99500 @ 25.00 °C.
boiling point : 336.00 °C. @ 760.00 mm Hg
logp : 5.90
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) :> 212.00  °F.  TCC  ( > 100.00 °C. )
  
recommendation for octyl cinnamate usage levels up to :
  6.0000 % in the fragrance concentrate.
  
safety links : 
(EINECS) number :273-842-1
chemidplus :069038784
epa-srs :69038-78-4
  
other : 
 
references : 
pubchem :3762280
  
synonyms :
 octyl cinnamate
3-phenyl acrylic acid octyl ester
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
 labdanum resinoid
 oakmoss absolute
 patchouli oil
 sandalwood oil
 vetiver oil
(odor and/or flavor) used in :
 balsam
 broom genet genista
 heather
 opoponax
 woody
natural occurrence in :
not found in nature



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