ethyl undecylenate
 
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IUPAC name :ethyl undec-10-enoate
InChI :InChI=1/C13H24O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3H,1,4-12H2,2H3
InChIKey :FXNFFCMITPHEIT-UHFFFAOYAO
SMILES :CCOC(=O)CCCCCCCCC=C
(EINECS) number :211-734-8
cas number :692-86-4
beilstein number :1769949
fema number :2461
coe number :10634
jecfa number :343
fl. number :09.237
molar refractivity :63.77 ± 0.3 cm3
parachor :563.0 ± 4.0 cm3
index of refraction :1.440 ± 0.02
surface tension :29.4 ± 3.0 dyne/cm
density :0.878 ± 0.06 g/cm3
polarizability :25.28 ± 0.5 10-24cm3
xlogp : 5.10
molecular weight : 212.3284600
formula :C13 H24 O2
 
 
export tariff code :unspecified
fda reg :unspecified
 

Suppliers :
Fontarome Chemical :ETHYL UNDECYLENOATE
Sigma-Aldrich-SAFC :Ethyl 10-undecenoate
≥97%

organoleptics :
odor type :fatty
odor strength :medium
odor description :
at 100.00 %.  
fatty waxy fruity sweet creamy soapy
substantivity :20  Hour(s)

properties :
appearence :colorless to pale yellow clear liquid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.87700 to 0.87900 @ 25.00 °C.
pounds per gallon - calc. : 7.298 to 7.314
refractive index :1.43600 to 1.44000 @ 20.00 °C.
boiling point : 258.00 to 259.00 °C. @ 760.00 mm Hg
boiling point : 132.00 to 133.00 °C. @ 10.00 mm Hg
acid value : 1.00  max.  KOH/g
PH number :25.00
logp : 5.15

safety :
Oral Toxicity(LD50) : Oral-Rat    >5000.00  mg/kg    (Moreno, 1977b)
Dermal Toxicity(LD50) : Skin-Rabbit  >5.00  gm/kg    
Maximised Survey-derived Daily Intakes (MSDI-EU) :1.50 (μg/capita/day)
flash point ( Deg. F. ) :> 230.00  °F.  TCC  ( > 110.00 °C. )
recommendation for ethyl undecylenate usage levels up to :
  10.0000 % in the fragrance concentrate.
recommendation for ethyl undecylenate usage levels up to :
  50.0000 ppm in the flavor.

safety references :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
EPI System :view
 
 
 ethyl undec-10-enoate
(EINECS) number :211-734-8
RTECS :YQ2978400 for 692-86-4
chemidplus :000692864
EPA Substance Registry Services :692-86-4
NLM Chemical Carcinogenesis Research Information System :692-86-4
NLM Developmental and Reproductive Toxicity :692-86-4
NLM Env. Mutagen Info. Center :692-86-4
NLM GENetic TOXicology :692-86-4

references :
 ethyl undec-10-enoate
jecfa number :343
fl. number :09.237
pubchem :156068
NIST Chemistry WebBook :196811249

other :
synonyms :
 ethyl 10-hendecenoate
 ethyl 10-undecenoate
 ethyl 10-undecylenate
 ethyl undec-10-enoate
 ethyl undecenoate
 ethyl undecylenate
10-undecenoic acid ethyl ester

soluble in :
 alcohol

insoluble in :
 water

(odor and/or flavor) blends with :
 algae absolute
 allyl amyl glycolate
 allyl cyclohexyl propionate
 allyl heptanoate
 allyl nonanoate
 allyl octanoate
 ambrette seed oil
 ambroxan
isoamyl benzoate
alpha-amyl cinnamaldehyde
alpha-amyl cinnamaldehyde / methyl anthranilate schiff's base
isoamyl isobutyrate
isoamyl laurate
isoamyl salicylate
6-amyl-alpha-pyrone
 amyris wood oil
 animal carbolactone
para-anisaldehyde
 anise seed oil
para-anisyl alcohol
 bay leaf oil
 benzoin resinoid
 benzophenone
 benzyl acetate
 benzyl benzoate
 benzyl isoeugenol
 benzyl laurate
 benzyl salicylate
 bois de rose oil
isobornyl acetate
laevo-bornyl acetate
isobutyl cinnamate
 butyl laurate
isobutyl salicylate
 caraway seed oil
 carrot seed oil
 cassia bark oil
 cedarleaf oil
 cedarwood oils
 cinnamyl alcohol
 cistus oil
 citronellol
 citrus carbaldehyde
 clary sage oil
 clove bud oil
 clover nitrile
 coriander seed oil
 cortex pyridine
 costus root oil
 costus valerolactone
para-cresyl caprylate
 cuminaldehyde
 currant bud absolute black
 cyclamen aldehyde
 cyclohexyl ethyl alcohol
 dairy lactone
 davana oil
2,4-decadien-1-ol
 decanal
 decanal / methyl anthranilate schiff's base
 decanol
3-decanone
(E)-2-decen-1-al
9-decen-1-al
(E)-2-decen-1-ol
(Z)-4-decen-1-ol
(Z)-5-decen-1-ol
9-decen-1-ol
(E)-2-decen-1-yl acetate
 decyl acetate
 decyl butyrate
 dimethyl benzyl carbinol
 dimethyl benzyl carbinyl acetate
 dimethyl benzyl carbinyl isobutyrate
 dimethyl hydroquinone
(E,E)-2,4-dodecadien-1-ol
 dodecanal
 dodecanol
 ethyl (E)-2-decenoate
 ethyl (E)-2-octenoate
 ethyl (E)-4-decenoate
 ethyl cinnamate
 ethyl decanoate
 ethyl hexanoate
 ethyl palmitate
 ethyl phenyl acetate
 ethyl undecanoate
 ethyl vanillin
 fir balsam absolute
 floral pyranol
 frankincense oil
1-furfuryl pyrrole
(E)-geranyl acetone
 geranyl hexanoate
 guaiacwood oil
 gurjun balsam oil
 hay absolute
 heliotropin
 heliotropyl acetone
 heliotropyl diethyl acetal
3-hexanone
(Z)-3-hexen-1-yl 2-methyl-2-pentenoate
(E)-2-hexen-1-yl acetate
(Z)-3-hexen-1-yl hexanoate
(Z)-3-hexen-1-yl propionate
(Z)-3-hexen-1-yl salicylate
 hexyl 2-methyl butyrate
 hexyl butyrate
alpha-hexyl cinnamaldehyde
 hexyl phenyl acetate
 hyacinth ether
 hydroxycitronellal
 immortelle absolute
 ionones
 jasmin absolute
 jasmin absolute pommade
 labdanum resinoid
 leerall
 lilyall
 linalool
laevo-linalool
 linalool oxide
 linalyl acetate
 marine pyridine
 melon nonenoate
 melon valerate
 methyl 10-undecenal
 methyl 2-undecynoate
 methyl 2,4-decadienoate
 methyl benzoate
 methyl butyl phenyl acetate
 methyl cedryl ketone
 methyl citronellate
 methyl dihydrojasmonate
 methyl ionones
 methyl laurate
 methyl myristate
4-methyl octanoic acid
 methyl phenyl acetate
 methyl undecanoate
 mimosa absolute
 musks
 myristic acid
 nerolidol
 neryl acetate
2,4-nonadien-1-ol
gamma-nonalactone
 nonanal
 nonanol
(Z)-2-nonen-1-al
(E)-2-nonen-1-yl acetate
 oakmoss absolute
 ocean propanal
gamma-octalactone
 octanal
 octanoic acid
(E)-2-octen-1-yl acetate
(E)-2-octen-1-yl butyrate
(E)-2-octenoic acid
 octyl 2-methyl butyrate
 octyl butyrate
 oleic acid
 orris pyridine
 palmitic acid
 patchouli ethanone
 patchouli oil
 peony alcohol
 phenethyl phenyl acetate
 phenethyl salicylate
 phenyl acetaldehyde dimethyl acetal
3-phenyl propyl alcohol
 phytyl acetate
 raspberry ketone methyl ether
 rose butanoate
 rose oxides
 santall
alpha-terpineol
 tetradecanal
 tetrahydrolinalool
 tobacco dodecane
 tonka bean absolute
(E)-2-tridecen-1-yl acetate
 undecanal
 undecanol
2-undecanone
10-undecen-1-al
10-undecen-1-yl acetate
 vanillyl acetate
 verymoss
 vetiver oil
 violet leaf absolute
 watermelon ketone
 woody acetate

(odor and/or flavor) used in :
 agrumen
 aldehydic
 alpine bouquet
 amaryllis
 amber
 ambrette
 animal
 apple
 apple crabapple
 ash mountain ash blossom
 azalea
 bark
 bayberry
 beeswax cire d'abeille
 berry
 bouquet
 boxwood
 boxwood blossom
 brandy
 bread
 broom genet genista
 burberry
 burnt
 cabochard
 caramel
 carrot seed
 cassia blossom
 castoreum
 cedar forest
 cedarwood
 cheese
 cherry blossom
 chypre
 cilantro
 clean
 clematis
 cloth clean cloths
 clove blossom
 coconut
 cognac
 cortex
 costus
 crabapple blossom
 cream
 cumin
 custard
 cyclamen
 cypress
 daffodil narcissus
 dairy
 daisy
 date
 earth humus
 elder blossom
 elderberry
 fenugreek
 fern fougere
 fig
 fir balsam
 fixer
 floral
 flouve blossom
 foliage
 forest
 fresh
 fruit dried fruit
 fungus
 galanga
 ginger white ginger
 gingergrass
 grape
 guaiacwood
 hair
 heather
 hollyberry
 incense
 ivy leaf
 leaf autumn leaf
 leaf green leaf
 leather
 lettuce
 liverwort
 lychee soapberry
 maja
 malt
 marjoram
 meadow
 milk malted milk
 mushroom
 musk
 new car
 oakmoss mousse de chene
 ocean sea breeze
 orchid
 orris iris
 osmanthus
 outdoors fresh outdoors
 pansy
 patchouli
 peach
 peach blossom
 pear
 petal waxy petal
 petunia
 pineapple
 plum blossom
 pork
 powder
 privet
 privet blossom
 rain
 raisin
 redwood
 reseda mignonette
 rose
 rose geranium
 rose tea rose
 rose white rose
 saffron
 seaweed
 soapy
 starfruit
 stephanotis
 strawberry
 tobacco tabac tabaco
 tonka
 tuberose tubereuse
 tulip

natural occurrence in :
not found in nature



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