floral undecenone
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IUPAC name :6,10-dimethylundec-9-en-2-one
InChI :InChI=1/C13H24O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,12H,5-6,8-10H2,1-4H3
InChIKey :LGVYUZVANMHKHV-UHFFFAOYAN
SMILES :CC(CCCC(=O)C)CCC=C(C)C
cas number :1322-58-3
(EINECS) number :215-340-7
molar refractivity :62.16 ± 0.3 cm3
parachor :535.1 ± 4.0 cm3
index of refraction :1.443 ± 0.02
surface tension :27.3 ± 3.0 dyne/cm
density :0.838 ± 0.06 g/cm3
polarizability :24.64 ± 0.5 10-24cm3
XlogP : 4.60
molecular weight : 196.3290600
formula :C13 H24 O
NMR Predictor :Predict
 
 
export tariff code :2914.23.0000
fda reg :unspecified

Suppliers :
IFF :Tetrameran
≥90% (sum of ketones)
Odor:  A natural floral, rosy, lavender, green bouquet with balsamic, woody undertones.

organoleptics :
odor type :floral
odor strength :medium
odor description :
at 100.00 %.  
sweet floral balsam rose woody dry
substantivity :24 hour(s) at 100.00 %

properties :
appearence :colorless to pale yellow clear liquid
assay : 95.00 to 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.85200 to 0.86200 @ 25.00 °C.
pounds per gallon - calc. : 7.089 to 7.173
refractive index :1.45400 to 1.46000 @ 20.00 °C.
boiling point : 282.00 to 283.00 °C. @ 760.00 mm Hg
boiling point : 126.00 to 127.00 °C. @ 14.00 mm Hg
flash point :> 212.00  °F.  TCC  ( > 100.00 °C. )
logP (o/w) : 4.48

safety :
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
 
recommendation for floral undecenone usage levels up to :
  10.0000 % in the fragrance concentrate.
recommendation for floral undecenone usage levels up to :
 not for flavor use.

safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
 
 
 6,10-dimethylundec-9-en-2-one
(EINECS) number :215-340-7
chemidplus :001322583
EPA Substance Registry Services :1322-58-3

references :
 6,10-dimethylundec-9-en-2-one
NIST Chemistry WebBook :1322583
pubchem :680077

Cosmetics :
Cosmetic uses : perfuming agents

other :
CosIng :cosmetic data
synonyms :
 dihydrogeranyl acetone
6,10-dimethyl undecen-2-one
6,10-dimethyl-2-undecenone
6,10-dimethylundec-9-en-2-one
 tetrameran

soluble in :
 alcohol
 water, very slightly

insoluble in :
 water

stability :
 acid cleaner
 alcoholic lotion
 antiperspirant
 deo stick
 detergent
 fabric softener
 hard surface cleaner
 shampoo
 soap

(odor and/or flavor) blends with :
 amber pentadecane
isoamyl 3-(2-furan) propionate
 amyl benzoate
alpha-amyl cinnamyl alcohol
 anisyl propanal / methyl anthranilate schiff's base
 apple ketal
1-benzoyl acetone
 benzyl methyl ether
 bergamot oil bergaptene free
 bergoxane
 bicyclogermacrene
 birch bud oil
 bornyl salicylate
isobutyl benzyl carbinol
alpha-butyl cinnamaldehyde
4-tert-butyl cyclohexane carboxaldehyde
isobutyl furyl propionate
alpha-cadinene
beta-cadinene
delta-cadinene
alpha-campholenic aldehyde
 cananga oil
 cananga oil china
beta-caryophyllene alcohol acetate
 cedarwood oil epoxidized
 cedrol methyl ether
 chrysanthemum oxide
 cinnamyl formate
 citral dimethyl acetal
 citronellyl acetate
 citronellyl acetone
 citronellyl propionate
 clary sage absolute
 cumin carbinol
 cuminyl acetaldehyde
isocyclogeraniol
 cyclohexyl crotonate
 cyclohexyl salicylate
2-decalinyl formate
 decanal propylene glycol acetal
3-decanone
(E)-4-decen-1-al
2-decen-1-al
 dihydrogeranyl linalool
2',4'-dimethyl acetophenone
 dimethyl benzyl carbinol
 dimethyl benzyl carbinyl butyrate
2,4-dimethyl cyclohexyl methyl acetate
 dimethyl succinate
6,8-dimethyl-2-nonanol
 earthy acetal
 elemi oil
alpha-elemol
 ethyl 2-benzyl butyrate
 ethyl formate
 ethyl methyl-para-tolyl glycidate
2-ethyl octine carbonate
isoeugenyl formate
 farnesyl acetate
 fenchyl alcohol
 floral butanal
 freesia heptanol
 fresh nitrile
 galbanum absolute
 galbanum oil
 galbanum oleoresin
 galbanum resinoid
 geranium absolute
 geranium oil
 geranyl acetone
 geranyl isobutyrate
 grapefruit pentanol
 guaiacyl acetate
 guaiene
 heptanol
(Z)-3-hexen-1-yl benzoate
(Z)-3-hexen-1-yl phenyl acetate
(E)-2-hexen-1-yl salicylate
(Z)-3-hexen-1-yl salicylate
alpha-hexyl cinnamaldehyde
 hydroxycitronellal diethyl acetal
6-hydroxydihydrotheaspirane (mixture of isomers)
beta-ionol
(E)-beta-ionone
alpha-ionone
beta-ionone
pseudoionone
alpha-irone
 ivy carbaldehyde / methyl anthranilate schiff's base
 ivy dioxolane
 jasmin cyclopentanol
 lavandin water absolute
 linaloe wood oil mexico
laevo-linalool
 linalool oxide
(Z)-linalool oxide (furanoid)
 marine hexane
 mesitene lactone
 methyl 2-undecynoate
 methyl cyclocitrone
para-methyl hydratropaldehyde
(E)-beta-methyl ionone
iso-alpha-methyl ionone
(E)-alpha-methyl ionone (50-60%)
 methyl ionone gamma supreme
 methyl octine carbonate
4-methyl-4-phenyl pentanone
alpha-methylene citronellal
 mimosa absolute
 muguet carbinol
 muguet undecadienal
 myrcenyl acetate
 neroli ketone
 neroli oil
 nerolidol
(Z)-6-nonen-1-al
 oakmoss absolute
 ocean propanal / methyl anthranilate schiff's base
 octanal dimethyl acetal
 octanal propylene glycol acetal
2-octanol
 octyl oxyacetaldehyde
 orange leaf absolute
 orris absolute
 papaya isobutyrate
 peach pivalate
 peanut oxazole
 phenethyl isopropyl ether
 phenethyl oxyacetaldehyde
 phenethyl tiglate
 phenyl acetaldehyde
 phenyl acetaldehyde diisobutyl acetal
2-phenyl propionaldehyde ethylene glycol acetal
3-phenyl propyl propionate
1-phenyl-1-propanol
4-phenyl-3-buten-2-ol
(Z,E)-phytol
 rose butanoate
(Z)-rose oxide
 sandal octanol
 seaweed absolute
 styralyl formate
 terpinyl isobutyrate
 terpinyl propionate
 timber propanol
 treemoss absolute
 tricyclo(5.2.1.02,6)dec-3-enyl acetate
 tricyclodecenyl acetate
 tropical ionone
 valerian absolute
 valerian root oil
 valerian root oil china
 valerian root oil CO2 extract china
 vetiver pentanone
 woody carboxylate
 woody epoxide
 woody ether
 woody propanol

(odor and/or flavor) used in :
 apple
 balsam
 blossom
 floral
 green
 peach
 woody

natural occurrence in :
not found in nature



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