maltyl isobutyrate
 
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IUPAC name :(2-methyl-4-oxopyran-3-yl) 2-methylpropanoate
InChI :InChI=1/C10H12O4/c1-6(2)10(12)14-9-7(3)13-5-4-8(9)11/h4-6H,1-3H3
InChIKey :VSBHYRPUJHEOBE-UHFFFAOYAN
SMILES :CC1=C(C(=O)C=CO1)OC(=O)C(C)C
(EINECS) number :265-755-2
cas number :65416-14-0
fema number :3462
coe number :10739
jecfa number :1482
fl. number :09.525
molar refractivity :49.35 ± 0.4 cm3
parachor :417.6 ± 6.0 cm3
index of refraction :1.495 ± 0.03
surface tension :37.2 ± 5.0 dyne/cm
density :1.16 ± 0.1 g/cm3
polarizability :19.56 ± 0.5 10-24cm3
xlogp : 1.20
molecular weight : 196.1998800
formula :C10 H12 O4
 
 
fda reg :unspecified h. number :2915.60.0000
organoleptics : 
odor type :caramellic
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description :
at 10.00 % in propylene glycol.  
sweet strawberry fruity tropical berry cotton candy
taste description³ :at 10.00 - 30.00 ppm.  
Sweet, jamy, fruity, milky, caramellic with bubble gum and cotton candy nuances
substantivity :400  Hour(s)
properties : 
appearence :pale yellow liquid
assay : 98.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :1.14100 - 1.15100 @ 25.00 °C.
pounds per gallon - calc. : 9.494 to 9.577
refractive index :1.49300 - 1.50100 @ 20.00 °C.
boiling point : 176.00 °C. @ 7.00 mm Hg
logp : 1.36
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 200.00  °F.  TCC  ( 93.33 °C. )
  
recommendation for maltyl isobutyrate usage levels up to :
  8.0000 % in the fragrance concentrate.
  
recommendation for maltyl isobutyrate usage levels up to :
  30.0000 ppm in the flavor.
  
safety links : 
(EINECS) number :265-755-2
chemidplus :065416140
epa-srs :65416-14-0
  
other : 
 
references : 
pubchem :198967
  
reference : Mosciano, Gerard P&F 25, No. 4, 71, (2000)³
synonyms :
 maltyl 2-methyl propanoate
 maltyl isobutyrate
2-methyl propanoic acid 2-methyl-4-oxo-4H-pyran-3-yl ester
2-methyl-4-oxo-4H-pyran-3-yl 2-methyl propanoate
2-methyl-4-oxo-4H-pyran-3-yl isobutyrate
2-methyl-4-oxopyran-3-yl isobutyrate
2-methyl-4-pyron-3-yl 2-methyl propanoate
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) used in :
 apricot
 berry
 blueberry
 bread
 bubblegum
 candy cotton candy
 caramel
 cheese
 custard
 dairy
 eggnog
 guava
 kiwi
 melon
 peach
 pineapple
 raspberry
 rose
 strawberry
natural occurrence in :
not found in nature



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