5(6)-decenoic acid
 
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IUPAC name :(E)-dec-2-enoic acid
InChI :InChI=1/C10H18O2/c1-2-3-4-5-6-7-8-9-10(11)12/h8-9H,2-7H2,1H3,(H,11,12)/b9-8+/f/h11H
InChIKey :WXBXVVIUZANZAU-LJLVIWCIDE
SMILES :CCCCCCC\C=C\C(=O)O
cas number :72881-27-7
fema number :3742
jecfa number :327
fl. number :08.068
molar refractivity :49.99 ± 0.3 cm3
parachor :439.0 ± 4.0 cm3
index of refraction :1.462 ± 0.02
surface tension :33.9 ± 3.0 dyne/cm
density :0.936 ± 0.06 g/cm3
polarizability :19.82 ± 0.5 10-24cm3
xlogp : 4.00
molecular weight : 170.2487200
formula :C10 H18 O2
 
 
fda reg :unspecified h. number :2932.29.6000
organoleptics : 
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
bitter
properties : 
appearence :colorless clear liquid
assay : 95.00 - 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.91600 - 0.94500 @ 25.00 °C.
pounds per gallon - calc. : 7.622 to 7.863
refractive index :1.44700 - 1.46000 @ 20.00 °C.
boiling point : 277.00 - 278.00 °C. @ 760.00 mm Hg
logp : 3.99
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
Maximised Survey-derived Daily Intakes (MSDI) :3.40 (μg/capita/day)
  
flash point ( Deg. F. ) : 365.00  °F.  TCC  ( 185.00 °C. )
  
safety links : 
chemidplus :072881277
epa-srs :72881-27-7
  
other : 
 
references : 
pubchem :733155
NIST Chemistry WebBook :2491028564
  
synonyms :
 cocoa lactone
 cocolactone (ex massoia)
 dec-(5- and 6)-enoic acid
 decenoic acid
5- and 6-decenoic acid
5(6)-decenoic acid
 milk lactone prime
soluble in :
 alcohol
insoluble in :
 water
natural occurrence in :
not found in nature



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