(E)-2-nonen-1-yl acetate
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IUPAC name :[(E)-non-2-enyl] acetate
InChI :InChI=1/C11H20O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h8-9H,3-7,10H2,1-2H3/b9-8+
InChIKey :WFCCNPHGLLPSDJ-CMDGGOBGBP
SMILES :CCCCCC\C=C\COC(=O)C
cas number :30418-89-4
% from :95.00% to 99.90%
(EINECS) number :250-190-6
fema number :4552
molar refractivity :54.84 ± 0.3 cm3
parachor :481.7 ± 4.0 cm3
index of refraction :1.442 ± 0.02
surface tension :29.2 ± 3.0 dyne/cm
density :0.889 ± 0.06 g/cm3
polarizability :21.74 ± 0.5 10-24cm3
XlogP : 4.10
XlogP3-AA : 3.60
molecular weight : 184.2753000
formula :C11 H20 O2
NMR Predictor :Predict
 
 
IUPAC name :[(Z)-non-2-enyl] acetate
InChI :InChI=1/C11H20O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h8-9H,3-7,10H2,1-2H3/b9-8-
InChIKey :WFCCNPHGLLPSDJ-HJWRWDBZBJ
SMILES :CC(=O)OC/C=C\CCCCCC
cas number :30418-89-4  (Z)
% from :0.10% to 4.00%
molar refractivity :54.84 ± 0.3 cm3
parachor :481.7 ± 4.0 cm3
index of refraction :1.442 ± 0.02
surface tension :29.2 ± 3.0 dyne/cm
density :0.889 ± 0.06 g/cm3
polarizability :21.74 ± 0.5 10-24cm3
XlogP : 4.10
molecular weight : 184.2753000
formula :C11 H20 O2
NMR Predictor :Predict
 
 
export tariff code :2915.39.9050
fda reg :unspecified
Suppliers :
Bedoukian Research :trans-2-NONENYL ACETATE
≥95.0% (trans), Kosher
Odor:  Fruity, waxy-citrus character.
Penta :TRANS-2-NONENYL ACETATE
organoleptics :
odor type :fruity
odor strength :medium
odor description :
at 100.00 %.  		fruity waxy citrus sweet
properties :
appearence :colorless clear liquid
assay : 96.00 to 100.00 %   sum of isomers
Food Chemicals Codex Listed :No
specific gravity :0.87000 to 0.89000 @ 25.00 °C.
pounds per gallon - calc. : 7.239 to 7.406
refractive index :1.42500 to 1.44500 @ 20.00 °C.
boiling point : 110.00 °C. @ 2.00 mm Hg
boiling point : 236.00 to 237.00 °C. @ 760.00 mm Hg
vapor density :>1 ( Air = 1 )
flash point : 210.00  °F.  TCC  ( 98.89 °C. )
logP (o/w) : 4.17
safety :
most important hazard(s) :Xi - Irritant
  R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36 - Wear suitable protective clothing.
Oral Toxicity(LD50) :
  Not determined
Dermal Toxicity(LD50) :
  Not determined
Inhalation Toxicity(LC50) :
  Not determined
 
safety in use :
 
recommendation for (E)-2-nonen-1-yl acetate usage levels up to :
  0.5000 % in the fragrance concentrate.
 
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA on the "LIBRARY" link.
publication number : 24
 average usual ppmaverage maximum ppm
baked goods : -0.10000
beverages(nonalcoholic) : -0.10000
beverages(alcoholic) : -0.10000
breakfast cereal : -0.10000
cheese : --
chewing gum : -0.10000
condiments / relishes : --
confectionery froastings : -0.10000
egg products : --
fats / oils : -0.10000
fish products : --
frozen dairy : -0.10000
fruit ices : -0.10000
gelatins / puddings : -0.10000
granulated sugar : --
gravies : --
hard candy : -0.10000
imitation dairy : --
instant coffee / tea : --
jams / jellies : -0.10000
meat products : -0.10000
milk products : -0.10000
nut products : --
other grains : --
poultry : --
processed fruits : --
processed vegetables : --
reconstituted vegetables : --
seasonings / flavors : 2.0000010.00000
snack foods : --
soft candy : --
soups : --
sugar substitutes : --
sweet sauces : --
safety references :
EPI System :view
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 [(E)-non-2-enyl] acetate
(EINECS) number :250-190-6
chemidplus :030418894
EPA Substance Registry Services :30418-89-4
 [(Z)-non-2-enyl] acetate
references :
 [(E)-non-2-enyl] acetate
pubchem :698200
 [(Z)-non-2-enyl] acetate
other :
VCF-Online: VCF Volatile Compounds in Food
synonyms :
(E)-non-2-enyl acetate
[(E)-non-2-enyl] acetate
(E)-nonen-1-ol acetate
trans-2-nonen-1-yl acetate
(E)-2-nonenyl acetate
trans-2-nonenyl acetate
soluble in :
 alcohol
insoluble in :
 water
(odor and/or flavor) blends with :
 allyl 10-undecenoate
 allyl cyclohexyl propionate
isoamyl 2-methyl butyrate
alpha-amyl cinnamyl alcohol
 basil oil
 blackberry thiophenone
 butyl lactate
 cadinadiene
 cinnamyl butyrate
 cinnamyl formate
 cinnamyl isovalerate
 citronellyl ethyl ether
 citronellyl hexanoate
 citronellyl phenyl acetate
(E)-citronellyl tiglate
 citrus carbaldehyde
 citrus carbaldehyde / methyl anthranilate schiff's base
 citrus propanol
(-)-alpha-cubebene
 cumin carbinol
 cyclohexyl propionate
(E,E)-2,4-decadien-1-al
2,4-decadien-1-al
2,4-decadien-1-ol
 decanal
 decanal dimethyl acetal
3-decanone
2,4,7-decatrien-1-al
3-decen-2-one
 decyl butyrate
 dehydro beta-linalool
 diethyl dimethyl-2-cyclohexenone
2,4-difurfuryl furan
 dihydrocitronellyl ethyl ether
 dihydronootkatone
(E+Z)-4,8-dimethyl-3,7-nonadien-2-one
2-dodecanone
beta-elemene
 ethyl (E,Z)-2,4-decadienoate
 ethyl (E)-4-decenoate
 ethyl 2-(methyl dithio) propionate
 ethyl 2-octenoate
 ethyl cinnamate
 ethyl hexanoate
 ethyl isobutyrate
 ethyl myristate
 ethyl nonanoate
 ethyl octanoate
 ethylene dodecanoate
(E)-beta-farnesene
(E,E)-farnesyl acetate
 furfuryl isovalerate
1-furfuryl pyrrole
(E)-geranyl acetone
 geranyl butyrate
 geranyl oxyacetaldehyde
 grape butyrate
 grapefruit indene
 grapefruit menthane
 grapefruit octenone
 grapefruit oil
 grapefruit pentanol
 green carboxylate
 green hexanal
 heptanal cyclic ethylene acetal
3-heptyl dihydro-5-methyl-2(3H)-furanone
3-hexanone
3-hexen-1-al
(Z)-3-hexen-1-yl (Z)-3-hexenoate
(Z)-3-hexen-1-yl 2-methyl-2-pentenoate
(Z)-3-hexen-1-yl hexanoate
(E)-2-hexen-1-yl isovalerate
(Z)-3-hexen-1-yl lactate
(Z)-3-hexen-1-yl oxyacetaldehyde
 hexoxyacetaldehyde dimethyl acetal
 hexyl 2-methyl butyrate
 hexyl 2-methyl-3-pentenoate
 hexyl butyrate
alpha-hexyl cinnamaldehyde
 hexyl octanoate
 hexyl propionate
 hydroxycitronellal
beta-ionyl acetate
 ivy carbaldehyde
2,4-ivy carbaldehyde
3,5-ivy carbaldehyde
3,6-ivy carbaldehyde
 jasmin cyclopentanol
 lily propanol
 lilyall
 linalyl butyrate
 linalyl formate
 magnolia indene
 maltyl isobutyrate
 mandarine undecenal
 mango thiol
 marine carbonitrile
 marine decadienal
 marine nitrile
 melon carboxaldehyde
 melon heptenal propylene glycol acetal
 melon nonenoate
 melon valerate
 methoxycitronellal
 methoxymelonal
 methyl 2-undecynoate
 methyl 2,4-decadienoate
 methyl butyl phenyl acetate
2-methyl decanal
 methyl heptine carbonate
 methyl nonanoate
 methyl octine carbonate
2-methyl undecanal
 methyl undecanoate
3-(5-methyl-2-furyl) butanal
 mimosa absolute
 muguet carbaldehyde
 muguet ethanol
 musk decenone
 musk nonane
 myrmac aldehyde
 myrtenyl acetate
 nerol
 nerolidol
(E,Z)-2,6-nonadien-1-al
(E,Z)-2,6-nonadien-1-al diethyl acetal
(Z,Z)-3,6-nonadien-1-ol
3,6-nonadien-1-ol
(E,Z)-3,6-nonadien-1-yl acetate
gamma-nonalactone
 nonanal
 nonanal dimethyl acetal
2,4,6-nonatrien-1-al
(E)-2-nonen-1-al
(Z)-2-nonen-1-al
(Z)-6-nonen-1-al
(E)-2-nonen-1-ol
(Z)-2-nonen-1-ol
(Z)-6-nonen-1-ol
(Z)-6-nonen-1-yl acetate
2-nonyn-1-al dimethyl acetal
 nootkatone
 ocean propanal
(E,E)-2,4-octadien-1-al
(E)-2-octen-1-al
(Z)-3-octen-1-ol
(Z)-5-octen-1-ol
(E)-2-octen-1-yl butyrate
 octyl 2-furoate
 octyl 2-methyl butyrate
 orange nitrile
 papaya isobutyrate
 pear valerate
 phenethyl hexanoate
 polylimonene
 propyl 2,4-decadienoate
 propyl isobutyrate
 propyl nonanoate
 rhodinol
 rose butanoate
beta-sinensal
 tangerine nitrile
alpha-terpineol
2-tetradecen-1-al
 tetrahydrolinalyl acetate
(E)-2-tridecen-1-al
(E)-2-tridecen-1-al
 tropical indene
 tropical thiazole
 undecanal dimethyl acetal
2-undecanol
(E)-2-undecen-1-al
(Z)-8-undecen-1-al
 vanillyl butyl ether
 violet dienyne
 watermelon ketone
 waxy aldehyde
 waxy nitrile
 waxy undecadienol
(odor and/or flavor) used in :
 aldehydic
 amber
 citrus
 fruit
 moss
 oriental
 waxy
natural occurrence in :
found in nature



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