isopropyl alcohol
Notes :
Will modifiy aldehydes without impairing fragrance.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :propan-2-ol
InChI :InChI=1/C3H8O/c1-3(2)4/h3-4H,1-2H3
InChIKey :KFZMGEQAYNKOFK-UHFFFAOYAH
SMILES :CC(C)O
(EINECS) number :200-661-7
eu annex :603-003-00-0
cas number :67-63-0
beilstein number :0635639
fema number :2929
jecfa number :277
fl. number :02.079
molar refractivity :17.44 ± 0.3 cm3
parachor :165.6 ± 4.0 cm3
index of refraction :1.376 ± 0.02
surface tension :22.6 ± 3.0 dyne/cm
density :0.791 ± 0.06 g/cm3
polarizability :6.91 ± 0.5 10-24cm3
xlogp : 0.40
molecular weight : 60.0950200
formula :C3 H8 O
BioActivity Analysis :17389846
 
 
fda reg :unspecified h. number :2905.12.0050
organoleptics : 
odor type :alcoholic
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in dipropylene glycol.  
alcohol
substantivity :4  Hour(s)
properties : 
appearence :colorless clear liquid
assay : 99.00 - 100.00 %   
Food Chemicals Codex Listed :Yes
specific gravity :0.77800 - 0.78900 @ 25.00 °C.
pounds per gallon - calc. : 6.474 to 6.565
refractive index :1.36700 - 1.37800 @ 20.00 °C.
melting point : -83.00 - -81.00 °C. @ 760.00 mm Hg
boiling point : 82.00 - 83.00 °C. @ 760.00 mm Hg
boiling point : 38.00 - 39.00 °C. @ 100.00 mm Hg
logp : 0.16
safety : 
most important hazard(s) : Xi - Irritant
  
Oral Toxicity(LD50) : Oral-Rat    5840.00  gm/kg    (Smyth & Carpenter, 1948)
Oral-Rat    5280.00  mg/kg    (Lehman & Chase, 1944)
Oral-Rat    5300.00  mg/kg    (Kimura et al., 1971a)
Oral-Rat    5330.00  mg/kg    (FDA, 1975a)
Oral-Mouse    5070.00  mg/kg    (FDA, 1975a)
Oral-Rabbit    5040.00  mg/kg    (Lehman & Chase, 1944)
Oral-Rabbit    7990.00  mg/kg    (Munch, 1972)
Dermal Toxicity(LD50) : Skin-Rabbit  12800.00  mg/kg    
Maximised Survey-derived Daily Intakes (MSDI) :84000.00 (μg/capita/day)
  
flash point ( Deg. F. ) : 53.00  °F.  TCC  ( 11.67 °C. )
  
recommendation for isopropyl alcohol usage levels up to :
  1.0000 % in the fragrance concentrate.
  
recommendation for isopropyl alcohol usage levels up to :
  75.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :200-661-7
rtecs :NT8050000 for 67-63-0
toxnet :67-63-0
epa-srs :67-63-0
  
other : 
 
references : 
pubchem :3776
  
synonyms :
 dimethyl carbinol
 petrohol
 propan-2-ol
2-propanol
isopropanol
isopropyl alcohol
sec-propyl alcohol
soluble in :
 alcohol
 ether
 water, 1000000 mg/L @ 25C
(odor and/or flavor) used in :
 aldehydic
 apple
 apricot
 banana
 bluebell
 cognac
 currant
 gooseberry
 green
natural occurrence in :
 apple
 cognac



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