herbal ketone
Notes :
Fixer for fern and lavender.
 
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IUPAC name :3-(hydroxymethyl)nonan-2-one
InChI :InChI=1/C10H20O2/c1-3-4-5-6-7-10(8-11)9(2)12/h10-11H,3-8H2,1-2H3
InChIKey :DIZUHEORFPDTIQ-UHFFFAOYAZ
SMILES :CCCCCCC(CO)C(=O)C
(EINECS) number :267-154-0
cas number :67801-33-6
molar refractivity :49.90 ± 0.3 cm3
parachor :449.1 ± 4.0 cm3
index of refraction :1.441 ± 0.02
surface tension :32.1 ± 3.0 dyne/cm
density :0.913 ± 0.06 g/cm3
polarizability :19.78 ± 0.5 10-24cm3
xlogp : 2.40
molecular weight : 172.2646000
formula :C10 H20 O2
 
 
fda reg :unspecified h. number :unspecified
organoleptics : 
odor type :herbal
odor strength :medium
odor description :
at 100.00 %.  
fresh sweet green weedy earthy herbal
substantivity :20  Hour(s)
properties : 
appearence :pale yellow clear liquid
assay : 60.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.89000 - 0.91000 @ 25.00 °C.
pounds per gallon - calc. : 7.406 to 7.572
specific gravity :0.89100 - 0.91100 @ 20.00 °C.
pounds per gallon - calc. : 7.423 to 7.589
refractive index :1.43900 - 1.44400 @ 20.00 °C.
melting point : -5.80 °C. @ 0.00 mm Hg
boiling point : 378.00 °C. @ 0.00 mm Hg
logp : 2.22
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 201.00  °F.  TCC  ( 93.89 °C. )
  
recommendation for herbal ketone usage levels up to :
  3.0000 % in the fragrance concentrate.
  
recommendation for herbal ketone usage levels up to :
 not for flavor use.
  
safety links : 
(EINECS) number :267-154-0
chemidplus :067801336
epa-srs :67801-33-6
  
other : 
 
references : 
pubchem :684045
  
synonyms :
 herbal ketone
3-(hydroxmethyl)-2-nonanone
 hydroxymethyl heptyl methyl ketone
3-(hydroxymethyl) nonan-2-one
 methyl lavender ketone
soluble in :
 alcohol
insoluble in :
 water
stability :
 acid cleaner
 alcoholic lotion
 antiperspirant
 deo stick
 detergent
 fabric softener
 hard surface cleaner
 shampoo
 soap
(odor and/or flavor) used in :
 fern fougere
 floral
 green
 herbal
 lavender
 leaf
 mushroom
 woody
natural occurrence in :
found in nature



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