2,5-diethyl thiazole
 
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IUPAC name :2,5-diethyl-1,3-thiazole
InChI :InChI=1/C7H11NS/c1-3-6-5-8-7(4-2)9-6/h5H,3-4H2,1-2H3
InChIKey :PATFUZGQWONVOC-UHFFFAOYAL
SMILES :CCC1=CN=C(S1)CC
(EINECS) number :239-823-7
cas number :15729-76-7
fl. number :15.052
molar refractivity :41.82 ± 0.3 cm3
parachor :337.7 ± 4.0 cm3
index of refraction :1.519 ± 0.02
surface tension :36.1 ± 3.0 dyne/cm
density :1.025 ± 0.06 g/cm3
polarizability :16.58 ± 0.5 10-24cm3
xlogp : 0.80
molecular weight : 141.2339400
formula :C7 H11 N S
 
 
fda reg :unspecified h. number :2934.10.0000
organoleptics : 
odor strength :high ,
recommend smelling in a 0.01 % solution or less
odor description :
at 0.01 % in propylene glycol.  
meaty musty nutty
properties : 
appearence :colorless clear liquid
assay : 95.00 - 100.00 %   
Food Chemicals Codex Listed :No
boiling point : 191.00 - 193.00 °C. @ 760.00 mm Hg
logp : 2.62
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 153.00  °F.  TCC  ( 67.22 °C. )
  
recommendation for 2,5-diethyl thiazole usage levels up to :
  0.0200 % in the fragrance concentrate.
  
safety links : 
(EINECS) number :239-823-7
chemidplus :015729767
epa-srs :15729-76-7
  
other : 
 
references : 
fl. number :15.052
pubchem :661935
NIST Chemistry WebBook :2121083181
  
synonyms :
2,5-diethyl thiazole
2,5-diethyl-1,3-thiazole
2,5-diethylthiazole
soluble in :
 alcohol
insoluble in :
 water
natural occurrence in :
coffee



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