farnesyl acetone
Notes :
Floral and fruit fixer.
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :6,10,14-trimethylpentadeca-5,9,13-trien-2-one
InChI :InChI=1/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3
InChIKey :LTUMRKDLVGQMJU-UHFFFAOYAW
SMILES :CC(=CCCC(=CCCC(=CCCC(=O)C)C)C)C
(EINECS) number :212-097-9
cas number :762-29-8
fema number :3442
coe number :11206
jecfa number :1123
fl. number :07.114
molar refractivity :85.17 ± 0.3 cm3
parachor :703.5 ± 4.0 cm3
index of refraction :1.474 ± 0.02
surface tension :29.0 ± 3.0 dyne/cm
density :0.866 ± 0.06 g/cm3
polarizability :33.76 ± 0.5 10-24cm3
xlogp : 4.00
molecular weight : 262.4302000
formula :C18 H30 O
 
 
IUPAC name :(5E,9E)-6,10,14-trimethylpentadeca-5,9,13-trien-2-one
InChI :InChI=1/C18H30O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h9,11,13H,6-8,10,12,14H2,1-5H3/b16-11+,17-13+
InChIKey :LTUMRKDLVGQMJU-IUBLYSDUBO
SMILES :CC(=CCC/C(=C/CC/C(=C/CCC(=O)C)/C)/C)C
(EINECS) number :212-097-9
cas number :762-29-8
fema number :3442
coe number :11206
jecfa number :1123
fl. number :07.114
molar refractivity :85.17 ± 0.3 cm3
parachor :703.5 ± 4.0 cm3
index of refraction :1.474 ± 0.02
surface tension :29.0 ± 3.0 dyne/cm
density :0.866 ± 0.06 g/cm3
polarizability :33.76 ± 0.5 10-24cm3
xlogp : 4.00
molecular weight : 262.4302000
formula :C18 H30 O
 
 
export tariff code :2914.19.0000
fda reg :unspecified
 

Suppliers :
Bedoukian Research :FARNESYL ACETONE
 ≥95.0%, Kosher
 
Sigma-Aldrich-Fluka :Farnesylacetone
 technical, mixture of stereo isomers, ≥90% (GC)
 
 

organoleptics :
odor type :fruity
odor strength :medium
odor description :
at 100.00 %.  
fruity wine floral creamy

properties :
appearence :pale greenish yellow clear liquid
assay : 95.00 - 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.87000 - 0.88000 @ 25.00 °C.
pounds per gallon - calc. : 7.239 to 7.322
refractive index :1.47600 - 1.48600 @ 20.00 °C.
boiling point : 147.00 - 148.00 °C. @ 0.50 mm Hg
boiling point : 302.00 °C. @ 760.00 mm Hg
logp : 6.16

safety :
Oral Toxicity(LD50) : Oral-Rat   [sex: M,F]  >5000.00  mg/kg    (De Groot et al., 1974)
Dermal Toxicity(LD50) : Not determined
Maximised Survey-derived Daily Intakes (MSDI-EU) :0.085 (μg/capita/day)
  
flash point ( Deg. F. ) : 230.00  °F.  TCC  ( 110.00 °C. )
  
recommendation for farnesyl acetone usage levels up to :
  5.0000 % in the fragrance concentrate.
  
recommendation for farnesyl acetone usage levels up to :
  2.0000 ppm in the flavor.
  

safety links :
(EINECS) number :212-097-9
chemidplus :000762298
epa-srs :762-29-8
  
(EINECS) number :212-097-9
chemidplus :001117528
epa-srs :762-29-8
  

other :
 

references :
jecfa number :1123
fl. number :07.114
pubchem :197467
NIST Chemistry WebBook :1264637772
  
jecfa number :1123
fl. number :07.114
pubchem :213871
NIST Chemistry WebBook :2170072474)
  
synonyms :
 farnesyl acetone
6,10,14-trimethyl pentadeca-5,9,13-trien-2-one
 trimethyl pentadecatrien-2-one
2,6,10-trimethyl-2,6,10-pentadecatrien-14-one
6,10,14-trimethyl-5,9,13-pentadecatrien-2-one
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
 acetal 318
1-acetyl cyclohexyl acetate
 acetyl isovaleryl
 allyl nonanoate
isoamyl 3-(2-furan) propionate
isoamyl acetoacetate
 amyl angelate
isoamyl angelate
alpha-amyl cinnamaldehyde
isoamyl laurate
 amyl octanoate
isoamyl tiglate
2-amyl-5 or 6-keto-1,4-dioxane
para-anisyl formate
 benzaldehyde / methyl anthranilate schiff's base
 benzaldehyde dimethyl acetal
 benzyl acetate
 benzyl acetoacetate
 benzyl cinnamate
 benzyl formate
isobutyl acetoacetate
isobutyl alcohol
 butyl angelate
 butyl anthranilate
isobutyl anthranilate
isobutyl furyl propionate
 butyl hexanoate
 butyl lactate
2-butyl thiophene
 butyl undecylenate
isobutyraldehyde propylene glycol acetal
 chamomile isobutyrate
 chamomile propionate
 chamomile valerate
 cinnamyl formate
 citronellyl butyrate
 citronellyl hexanoate
 citronellyl isobutyrate
 citronellyl propionate
(E)-citronellyl tiglate
 clary propyl acetate
 clary sage concrete
 cognac oil green
 cognac oil white
 dairy lactone
(E)-beta-damascone
(Z)-beta-damascone
beta-damascone
gamma-decalactone
2-decalinyl acetate
 diethyl 1-malate
 diethyl laevo-tartrate
 diethyl malate
 diethyl sebacate
2,4-difurfuryl furan
 dihydrojasmone
 dimethyl anthranilate
 dimethyl benzyl carbinyl acetate
S-(2,5-dimethyl-3-furyl) ethane thioate
(E+Z)-4,8-dimethyl-3,7-nonadien-2-one
 eriocephalus punctulatus oil
 ethyl 2-furoate
 ethyl 3,5,5-trimethyl hexanoate
 ethyl aconitate
 ethyl chrysanthemate
 ethyl heptanoate
 ethyl levulinate
 ethyl nonanoate
 ethyl octanoate
4-ethyl octanoic acid
 ethyl palmitate
 ethyl undecylenate
2-ethyl-4-butanol
 geraniol
 geranyl acetoacetate
 heptanal
2-heptanol
 heptyl isobutyrate
2-hexanol
(Z)-3-hexen-1-yl butyrate
(Z)-3-hexen-1-yl isovalerate
 hexoxyacetaldehyde dimethyl acetal
 hexyl isobutyrate
 hexyl phenyl acetate
2-hexyl-4-acetoxytetrahydrofuran
 menthadienyl formate
3-mercaptohexyl acetate
 methoxymelonal
 methyl (Z)-3-hexenoate
 methyl 4-phenyl butyrate
 methyl alpha-ionone
 methyl benzyl acetate (mixed ortho-,meta-,para-)
 methyl cyclogeranate
 methyl decanoate
 methyl hydrocinnamate
alpha-isomethyl ionone (90% min.)
 methyl ionyl acetate
 methyl isobutyrate
 methyl nonanoate
2-methyl-1-butanol
(E)-7-methyl-3-octen-2-one
3-nonanon-1-yl acetate
 opoponax oil
 opoponax resinoid
 orris root concrete
2-pentanone
 petitgrain lemon oil
 phenethyl isobutyrate
 phenethyl isovalerate
 phenethyl senecioate
1-phenyl propyl butyrate
2-phenyl propyl isobutyrate
4-phenyl-3-buten-2-ol
2-phenyl-4-pentenal
isopropyl benzoate
 propyl heptanoate
 rhubarb pyran
 rose oil
 rose undecene
 sorbyl butyrate
 sorbyl propionate
 terpinyl cinnamate
 terpinyl valerate
 tetrahydroionyl acetate
4-(para-tolyl)-2-butanone
 tropical ionone
 vanillyl isobutyrate
(odor and/or flavor) used in :
 fixer
 floral
 fruit
 tomato
natural occurrence in :
data pagecerastium candidissimum corr. oil greece @ 4.20%
data pagelaurel leaf oil turkey @ <0.10%
tomato



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