leaf acetal
Suppliers  organoleptics  properties  safety  references  cosmetics    FEMA Index    Home Page
Notes :
Green topnotes>
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :(E)-1-(1-ethoxyethoxy)hex-3-ene
InChI :InChI=1/C10H20O2/c1-4-6-7-8-9-12-10(3)11-5-2/h6-7,10H,4-5,8-9H2,1-3H3/b7-6+
InChIKey :PAEBAEDUARAOSG-VOTSOKGWBW
SMILES :CC\C=C\CCOC(C)OCC
cas number :28069-74-1
(EINECS) number :248-817-3
fema number :3775
coe number :10034
jecfa number :943
fl. number :06.081
molar refractivity :51.88 ± 0.3 cm3
parachor :453.9 ± 4.0 cm3
index of refraction :1.431 ± 0.02
surface tension :26.3 ± 3.0 dyne/cm
density :0.859 ± 0.06 g/cm3
polarizability :20.56 ± 0.5 10-24cm3
XlogP : 2.80
XlogP3-AA : 2.60
molecular weight : 172.2646000 (IUPAC)
formula :C10 H20 O2
NMR Predictor :Predict
 
 
export tariff code :2911.00.5000
fda reg :unspecified
Suppliers :
Apple :Leaf acetal
Bedoukian Research :LEAF ALCOHOL (ETHYL) ACETAL
≥98.0%, Kosher
Odor:  leafy, green vegetable-like
Adds a green top note; stable to alkali.
Flavor:  green
An intense odor that is used to add brightness and character to bell pepper, cucumber and green bean flavors.
Cargill :ACETALDEHYDE ETHYL cis-3-HEXENYL ACETAL
natural, Kosher
Odor:  Powerful, Green, Herbaceous-Vegetable
Citrus and Allied Essences :cis-3-Hexenyl Acetal
Fontarome :LEAF ACETAL
Odor:  Earthy mushroom-like
Hofmen :Acetaldethde, ethyl cis-3-hexenyl acetal
98%
Inoue :ACETALDEHYDE ETHYL CIS3HEXENYL ACETAL
Penta :leaf acetal
organoleptics :
odor type :green
odor strength :high ,
recommend smelling in a 10.00 % solution or less
odor description:
at 10.00 % in dipropylene glycol.  		green violet natural green leaf mushroom earthy
Luebke, William tgsc, (1984)
odor sample from :International Flavors & Fragrances Inc.
odor description:
at 2.00 %.  		green, vegetative, musty and radish-like with a raw, fruity nuance
Mosciano, Gerard P&F 22, No. 6, 41, (1997)
taste description:
at 10.00 ppm.  		Green, vegetative, grassy, musty and radish-like with a fruity nuance
Mosciano, Gerard P&F 22, No. 6, 41, (1997)
substantivity :4  Hour(s)
properties :
appearence :colorless clear liquid
assay : 97.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.84600 to 0.85600 @ 25.00 °C.
pounds per gallon - calc. : 7.040 to 7.123
specific gravity :0.84900 to 0.85600 @ 20.00 °C.
pounds per gallon - calc. : 7.073 to 7.131
refractive index :1.43000 to 1.43500 @ 20.00 °C.
boiling point : 195.00 to 196.00 °C. @ 760.00 mm Hg
boiling point : 85.00 °C. @ 7.00 mm Hg
acid value : 2.00  max.  KOH/g
vapor pressure :0.40000 mm/Hg @ 20.00 °C.
vapor density :>1 ( Air = 1 )
flash point : 180.00  °F.  TCC  ( 82.22 °C. )
logP (o/w) : 3.01
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 24/25 - Avoid contact with skin and eyes.
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) : 
  Oral-Rat    5000.00  mg/kg
Food and Chemical Toxicology. Vol. 26, Pg. 275, 1988.

Dermal Toxicity(LD50) : 
  Skin-Rabbit  >5000.00  mg/kg
Food and Chemical Toxicology. Vol. 26, Pg. 275, 1988.

Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :cosmetic, flavor and fragrance agents
Maximised Survey-derived Daily Intakes (MSDI-EU) :ND (μg/capita/day)
Maximised Survey-derived Daily Intakes (MSDI-USA) :0.00 (μg/capita/day)
Structure Class :I
 
recommendation for leaf acetal fragrance usage levels up to :
  1.0000 % in the fragrance concentrate.
recommendation for leaf acetal flavor usage levels up to :
  10.0000 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
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
 
WGK Germany :2
 
 
 
 
(E)-1-(1-ethoxyethoxy)hex-3-ene
(EINECS) number :248-817-3
chemidplus :028069741
EPA Substance Registry Services :28069-74-1
references :
 
(E)-1-(1-ethoxyethoxy)hex-3-ene
fl. number :06.081
jecfa number :943
pubchem :204953
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
RIFM :listed
FMA :listed
FDA Everything Added to Food in the United States (EAFUS)View
synonyms :
 acetaldehyde ethyl (Z)-3-hexen-1-yl acetal
 acetaldehyde ethyl cis-3-hexen-1-yl acetal
 acetaldehyde ethyl trans-3-hexenyl acetal
 acetaldehyde-(Z)-3-hexen-1-yl acetal
 acetaldehyde-cis-3-hexen-1-yl acetal
(Z)-1-(1-ethoxyethoxy) hex-3-ene
cis-1-(1-ethoxyethoxy) hex-3-ene
(E)-1-(1-ethoxyethoxy)hex-3-ene
 ethyl (Z)-3-hexen-1-yl acetal
cis-3-hexen-1-yl ethyl acetal
(Z)-3-hexen-1-yl ethyl acetal of acetaldehyde
cis-3-hexen-1-yl ethyl acetal of acetaldehyde
(Z)-3-hexenyl ethyl acetal of acetaldehyde
 leaf acetal
 leaf alcohol acetal
soluble in :
 alcohol
insoluble in :
 water
stability :
 alkalis
potential blenders :    note
 acetaldehyde butyl phenethyl acetalFL/FR
 acetaldehyde di-(Z)-3-hexen-1-yl acetalFL/FR
 acetaldehyde ethyl phenethyl acetalFL/FR
 allyl amyl glycolateFR
 allyl anthranilateFL/FR
isoamyl acetateFL/FR
isoamyl butyrateFL/FR
isoamyl isovalerateFL/FR
isoamyl salicylateFL/FR
 amyris wood oilFL/FR
para-anisyl acetateFL/FR
para-anisyl alcoholFL/FR
 basil absolute sweetFL/FR
 benzyl acetateFL/FR
 benzyl alcoholFL/FR
 benzyl benzoateFL/FR
 benzyl isobutyrateFL/FR
 benzyl propionateFL/FR
 benzyl salicylateFL/FR
 bergamot oilFL/FR
 blood orange oilFL/FR
 bois de rose oilFL/FR
 cassie absoluteFL/FR
 citronellolFL/FR
 citronellyl acetateFL/FR
 citrus carbaldehydeFR
 clary sage oilFL/FR
 clover nitrileFR
 coriander seed oilFL/FR
 cortex pyridineFL/FR
 cyclamen aldehydeFL/FR
neocyclocitralFR
 cyclohexyl ethyl alcoholFL/FR
 decanalFL/FR
 dibenzyl etherFL/FR
 dimethyl benzyl carbinolFL/FR
 earthy acetalFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 ethyl acetoacetateFL/FR
 ethyl cinnamateFL/FR
 ethyl heptanoateFL/FR
 floral pyranolFR
 galbanum oleoresinFL
 gardenia oxideFR
 geraniolFL/FR
 geranium absoluteFL/FR
 geranyl acetateFL/FR
(E)-geranyl acetoneFL/FR
 grapefruit pentanolFR
 green acetateFR
 heliotropyl acetoneFL/FR
 heptanal cyclic acetal with glycerolFL/FR
 heptanal glyceryl acetalFL/FR
 heptyl cinnamateFL/FR
 herbal heptaneFR
(E)-2-hexen-1-alFL
2-hexen-1-alFL
3-hexen-1-alFL/FR
(E)-2-hexen-1-olFL/FR
(Z)-2-hexen-1-olFL/FR
(Z)-3-hexen-1-olFL/FR
2-hexen-1-olFL/FR
3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (Z)-3-hexenoateFL/FR
(Z)-3-hexen-1-yl 2-methyl butyrateFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl benzoateFL/FR
(Z)-3-hexen-1-yl lactateFL/FR
(Z)-3-hexen-1-yl methyl carbonateFL/FR
(Z)-3-hexen-1-yl salicylateFL/FR
 hexoxyacetaldehyde dimethyl acetalFR
 hexyl 2-methyl butyrateFL/FR
 hexyl acetateFL/FR
alpha-hexyl cinnamaldehydeFL/FR
 hexyl tiglateFL/FR
 ho leaf oilFR
 hyacinth etherFR
 ionones 
2,4-ivy carbaldehydeFL/FR
 leafy acetalFL/FR
 leerallFR
 linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 linalyl acetateFL/FR
 marine pyridineFR
 melon heptenalFL/FR
 melon nonenoateFL/FR
 methyl 10-undecenalFL/FR
 methyl 2-methyl valerateFL/FR
 methyl cinnamateFL/FR
 methyl dihydrojasmonateFL/FR
 methyl heptenoneFL/FR
 methyl heptine carbonateFL/FR
 methyl octine carbonateFL/FR
tris(methyl thio) methaneFL
 methyl undecylenateFL/FR
3-methyl-3-pentanolFL
 mimosa absoluteFL/FR
 muguet carboxaldehydeFR
 nerolFL/FR
 nerolidolFL/FR
 neryl acetateFL/FR
(E,Z)-2,6-nonadien-1-olFL/FR
3,6-nonadien-1-olFL/FR
(E,Z)-2,6-nonadien-1-yl acetateFL/FR
 nonanalFL/FR
 nonanolFL/FR
(Z)-6-nonen-1-alFL/FR
(E)-2-nonen-1-olFL/FR
1-nonen-3-olFL/FR
2-nonyn-1-al dimethyl acetalFR
 ocean propanalFL/FR
 octanal dimethyl acetalFL/FR
1,8-octane dithiolFL
3-octanolFL/FR
(Z)-2-octen-1-al 
(Z)-5-octen-1-olFL/FR
(Z)-5-octen-1-yl propionateFL/FR
1-octen-3-oneFL/FR
 octyl 2-furoateFL
 octyl acetateFL/FR
 peony alcoholFR
 petitgrain combava oilCS
 petitgrain oilFL/FR
 phenethyl acetateFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
3-phenyl propionaldehydeFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
 plectranthus glandulosus hook f. leaf oil cameroon 
isopropyl phenyl propionaldehydeFR
 raspberry ketone methyl etherFL/FR
 rhodinolFL/FR
 rose butanoateFL/FR
 rose leaf absoluteFL/FR
 rosemary oleoresinFL/FR
 santallFR
 styralyl acetateFL/FR
alpha-terpineolFL/FR
 tetrahydrolinaloolFL/FR
 tuberose absoluteFL/FR
gamma-undecalactoneFL/FR
 verymossFR
 violet decenolFR
 violet dienyneFR
 violet leaf absoluteFL/FR
 violet methyl carbonateFR
 violet nitrileFR
 watermelon ketoneFR
 woody amyleneFR
potential uses :
 apple
 gardenia
 green
 guava
 herbal
 jasmin
 leaf
 lilac lilas syringa
 lily
 magnolia
 mushroom
 outdoors natural outdoors
 pear
 plum
 rose
 tropical
 violet
natural occurrence in :    note
 guava S
 plum  

information only - not sold by The Good Scents Company.


Please share your Information / Comments.

Your email Address:


Top of Page          The Good Scents Company Home
Copyright © 1980-2010 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 03/10/2010