2-isobutyl pyridine
 
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IUPAC name :2-(2-methylpropyl)pyridine
InChI :InChI=1/C9H13N/c1-8(2)7-9-5-3-4-6-10-9/h3-6,8H,7H2,1-2H3
InChIKey :BBVSPSDWPYWMOR-UHFFFAOYAK
SMILES :CC(C)CC1=CC=CC=N1
(EINECS) number :228-606-2
cas number :6304-24-1
fema number :3370
coe number :11395
jecfa number :1311
fl. number :14.058
molar refractivity :43.11 ± 0.3 cm3
parachor :354.9 ± 4.0 cm3
index of refraction :1.491 ± 0.02
surface tension :32.3 ± 3.0 dyne/cm
density :0.908 ± 0.06 g/cm3
polarizability :17.09 ± 0.5 10-24cm3
xlogp : 2.40
molecular weight : 135.2062200
formula :C9 H13 N
BioActivity Analysis :97165
 
 
export tariff code :2933.39.9050
fda reg :unspecified
 

Suppliers :
Treatt :2-Isobutylpyridine

organoleptics :
odor type :aromatic
odor strength :high ,
recommend smelling in a 0.10 % solution or less
odor description :
at 0.10 % in dipropylene glycol.  
strong aromatic

properties :
appearence :colorless to pale yellow clear liquid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.89400 to 0.90000 @ 25.00 °C.
pounds per gallon - calc. : 7.439 to 7.489
refractive index :1.48000 to 1.48600 @ 20.00 °C.
boiling point : 110.00 to 111.00 °C. @ 55.00 mm Hg
boiling point : 181.00 °C. @ 760.00 mm Hg
acid value : 1.00  max.  KOH/g
logp : 2.60

safety :
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
Maximised Survey-derived Daily Intakes (MSDI-EU) :ND (μg/capita/day)
flash point ( Deg. F. ) : 112.00  °F.  TCC  ( 44.44 °C. )
recommendation for 2-isobutyl pyridine usage levels up to :
 not for fragrance use.
recommendation for 2-isobutyl pyridine usage levels up to :
  0.2000 ppm in the flavor.

safety links :
 
 
(EINECS) number :228-606-2
chemidplus :006304241
EPA Substance Registry Services :6304-24-1
NLM Chemical Carcinogenesis Research Information System :6304-24-1
NLM Developmental and Reproductive Toxicity :6304-24-1
NLM Env. Mutagen Info. Center :6304-24-1
NLM GENetic TOXicology :6304-24-1
dtp/nci :42623
EPI System :view

other :

references :
jecfa number :1311
fl. number :14.058
pubchem :197645
synonyms :
2-isobutyl pyridine
2-isobutylpyridine
2-(2-methyl propyl) pyridine
2-(2-methylpropyl)pyridine

soluble in :
 alcohol

insoluble in :
 water

natural occurrence in :
not found in nature



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Html Last modified 11/25/2008