3-nonen-2-one
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :non-3-en-2-one
InChI :InChI=1/C9H16O/c1-3-4-5-6-7-8-9(2)10/h7-8H,3-6H2,1-2H3
InChIKey :HDKLIZDXVUCLHQ-UHFFFAOYAE
SMILES :CCCCCC=CC(=O)C
(EINECS) number :238-248-9
cas number :14309-57-0
fema number :3955
coe number :11163
jecfa number :1136
fl. number :07.188
molar refractivity :43.83 ± 0.3 cm3
parachor :382.4 ± 4.0 cm3
index of refraction :1.435 ± 0.02
surface tension :26.9 ± 3.0 dyne/cm
density :0.835 ± 0.06 g/cm3
polarizability :17.37 ± 0.5 10-24cm3
xlogp : 3.10
molecular weight : 140.2227400
formula :C9 H16 O
 
 
IUPAC name :(E)-non-3-en-2-one
InChI :InChI=1/C9H16O/c1-3-4-5-6-7-8-9(2)10/h7-8H,3-6H2,1-2H3/b8-7+
InChIKey :HDKLIZDXVUCLHQ-BQYQJAHWBQ
SMILES :CCCCC\C=C\C(=O)C
cas number :18402-83-0
molar refractivity :43.83 ± 0.3 cm3
parachor :382.4 ± 4.0 cm3
index of refraction :1.435 ± 0.02
surface tension :26.9 ± 3.0 dyne/cm
density :0.835 ± 0.06 g/cm3
polarizability :17.37 ± 0.5 10-24cm3
xlogp : 3.10
molecular weight : 140.2227400
formula :C9 H16 O
 
 
IUPAC name :(Z)-non-3-en-2-one
InChI :InChI=1/C9H16O/c1-3-4-5-6-7-8-9(2)10/h7-8H,3-6H2,1-2H3/b8-7-
InChIKey :HDKLIZDXVUCLHQ-FPLPWBNLBW
SMILES :CCCCC\C=C/C(=O)C
cas number :14309-57-0
molar refractivity :43.83 ± 0.3 cm3
parachor :382.4 ± 4.0 cm3
index of refraction :1.435 ± 0.02
surface tension :26.9 ± 3.0 dyne/cm
density :0.835 ± 0.06 g/cm3
polarizability :17.37 ± 0.5 10-24cm3
xlogp : 3.10
molecular weight : 140.2227400
formula :C9 H16 O
 
 
fda reg :unspecified h. number :2914.19.0000
organoleptics : 
odor type :fruity
odor strength :medium
odor description :
at 100.00 %.  
fruity berry
properties : 
appearence :colorless clear liquid
assay : 95.00 - 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.84300 - 0.85200 @ 25.00 °C.
pounds per gallon - calc. : 7.015 to 7.089
refractive index :1.44300 - 1.45200 @ 20.00 °C.
boiling point : 198.00 °C. @ 760.00 mm Hg
logp : 2.69
safety : 
Oral Toxicity(LD50) : Not determined
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) : 175.00  °F.  TCC  ( 79.44 °C. )
  
recommendation for 3-nonen-2-one usage levels up to :
  5.0000 % in the fragrance concentrate.
  
safety links : 
(EINECS) number :238-248-9
chemidplus :014309570
epa-srs :14309-57-0
  
chemidplus :018402830
epa-srs :18402-83-0
  
chemidplus :14309-57-0
epa-srs :14309-57-0
  
other : 
 
references : 
pubchem :169335
  
pubchem :754192
NIST Chemistry WebBook :3934246644
  
pubchem :10547247
NIST Chemistry WebBook :1378205529
  
synonyms :
 non-3-en-2-one
3-nonen-2-one
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) used in :
 berry
 blackberry
 blueberry
 fruit
 raspberry
 strawberry
natural occurrence in :
found in nature



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