linolenic acid
 
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IUPAC name :(9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid
InChI :InChI=1/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-/f/h19H
InChIKey :DTOSIQBPPRVQHS-PDBXOOCHBH
SMILES :CCC=CCC=CCC=CCCCCCCCC(=O)O
(EINECS) number :207-334-8
cas number :463-40-1
fema number :3380
coe number :695
fl. number :08.106
molar refractivity :87.17 ± 0.3 cm3
parachor :731.7 ± 4.0 cm3
index of refraction :1.490 ± 0.02
surface tension :34.8 ± 3.0 dyne/cm
density :0.924 ± 0.06 g/cm3
polarizability :34.56 ± 0.5 10-24cm3
xlogp : 5.90
molecular weight : 278.4296000
formula :C18 H30 O2
BioActivity Analysis :68740
 
 
export tariff code :2916.15.1000
fda reg :unspecified
 
 

organoleptics :

properties :
appearence :colorless to yellow clear liquid
assay : 90.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.91000 - 0.92000 @ 25.00 °C.
pounds per gallon - calc. : 7.572 to 7.655
refractive index :1.47900 - 1.48100 @ 20.00 °C.
melting point : -11.00 - -10.00 °C. @ 760.00 mm Hg
boiling point : 230.00 - 231.00 °C. @ 1.00 mm Hg

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
Maximised Survey-derived Daily Intakes (MSDI-EU) :110.00 (μg/capita/day)
  
flash point ( Deg. F. ) :> 230.00  °F.  TCC  ( > 110.00 °C. )
  

safety links :
(EINECS) number :207-334-8
chemidplus :000463401
epa-srs :463-40-1
dtp/nci :2042
  

other :
 

references :
fl. number :08.106
pubchem :68740
  
synonyms :
 linolenic acid
alpha-linolenic acid
 octadeca-9,12,15-trienoic acid
(Z,Z,Z)-octadeca-9,12,15-trienoic acid
(Z,Z,Z)-9,12,15-octadecatrienoic acid
all cis-9,12,15-octadecatrienoic acid
cis-delta9,12,15-octadecatrienoic acid
cis,cis,cis-9,12,15-octadecatrienoic acid
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) used in :
 antistatic agents
 emollients
natural occurrence in :
data pagechampaca concrete @ 0.50%
data pagegenet absolute @ 26.00%
rue seed
data pagethyme oil spain @ 2.45%



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