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acetaldehyde di-(Z)-3-hexen-1-yl acetal

Chemical Structure

General Material Information

Preferred name acetaldehyde di-(Z)-3-hexen-1-yl acetal
Trivial Name (3Z,3′Z)-1,1′-[Ethylidenebis(oxy)]bis[3-hexene]
Short Description acetaldehyde di-cis-3-hexenyl acetal
Formula C14 H26 O2
CAS Number 63449-64-9
FEMA Number 4381
ECHA Number 264-154-2
FDA UNII S23F4O70HS
Nikkaji Number J260.940A
xLogP3-AA 4.00 (est)
NMR Predictor External link
JECFA Food Flavoring 1747 acetaldehyde di-cis-3-hexenyl acetal
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 63449-64-9 ; ACETALDEHYDE DI-CIS-3-HEXENYL ACETAL
Synonyms
  • acetaldehyde di-(cis)-3-hexenyl acetal
  • acetaldehyde di-(Z)-3-hexenyl acetal
  • acetaldehyde di-cis-3-hexenyl acetal
  • acetaldehyde dicis3hexenyl acetal
  • acetaldehyde, di(cis-3-hexenyl)acetal
  • (Z,Z)-1,1'-( ethylidene bis(oxy)) di(hex-3-ene)
  • cis,cis-1,1'-( ethylidene bisoxy) dihex-3-ene
  • cis,cis-1,1'-( ethylidenebis-oxy)dihex-3-ene
  • (Z,Z)-1,1'-[ ethylidenebis(oxy)]di(hex-3-ene)
  • (3Z)-1-{1-[(3Z)- hex-3-en-1-yloxy]ethoxy}hex-3-ene
  • (Z)-1-[1-[(Z)- hex-3-enoxy]ethoxy]hex-3-ene
  • 3-hexene, 1,1'-(ethylidenebis(oxy))bis-, (3Z,3'Z)-
  • 3-hexene, 1,1'-(ethylidenebis(oxy))bis-, (Z,Z)-
  • 3-hexene, 1,1'-[ethylidenebis(oxy)]bis-, (3Z,3'Z)-
  • 3-hexene, 1,1'-[ethylidenebis(oxy)]bis-, (Z,Z)-
  • 3-hexene,1,1'-[ethylidenebis(oxy)]bis-,(3Z,3'Z)-
  • leaf alcohol (dihexenyl) acetal
  • (Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene
  • 3-Hexene, 1,1′-[ethylidenebis(oxy)]bis-, (3Z,3′Z)-
  • 3-Hexene, 1,1′-[ethylidenebis(oxy)]bis-, (Z,Z)-
  • (3Z,3′Z)-1,1′-[Ethylidenebis(oxy)]bis[3-hexene]

US / EU / FDA / JECFA / FEMA / Scholar / Patents

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Other Information

(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS):View
HMDB (The Human Metabolome Database):HMDB32152
FooDB:FDB008881
Export Tariff Code:2911.00.5000
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 226.35961914062
Specific gravity @ 25 °C
Pounds per Gallon 7.04 to 7.239
Refractive Index 1.442 to 1.448 @ 20 °C
Boiling Point 278 to 279°C @ 760 mm Hg
Acid Value 1 max KOH/g
Vapor Pressure 0.007 mmHg @ 25 °C
Flash Point TCC Value 80.56 °C TCC
logP (o/w) 4.882 est
Solubility
alcohol Yes
water, 3.061 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Green
green, leafy, herbal
General comment At 10.00 % in dipropylene glycol. green leafy herbal

Potential Uses

Applications
Odor purposes Acacia, Agate, Agrumen aldehyde, Ajowan, Algae, Alpine bouquet, Amaryllis, Angelica, Apple green apple, Arnica flower, Asafoetida, Ash mountain ash berry, Autumn, Avocado, Balsam, Basil oil replacer, Bayberry, Bayberry, Blue grass, Boxwood, Boxwood blossom, Boxwood berry, Cajeput, Calamus oil replacer, Camphor tree bark, Caraway seed, Carrot seed, Celery, Chamomile, Chrysanthemum, Cilantro, Clary sage oil replacer, Clematis, Cognac, Coriander, Cortex, Costus, Country meadow, Cranberry, Cubeb, Cucumber, Currant bud absolute replacer, Cypress oil replacer, Daffodil, Davana oil replacer, Deertongue absolute replacer, Dill weed, Elder flower, Elemi, Eucalyptus oil replacer, Evergreen, Fennel, Fern, Fig, Fir balsam, Flouve, Foliage, Forest, Galbanum, Genet, Geranium, Ginger white ginger, Gingergrass, Green, Green grass, Green leaf, Guava, Heather, Herbal, Hollyberry, Hop, Hyacinth, Hydrangea, Hyssop, Ivy, Jonquil, Lavandin, Lavender, Lavender flower, Lavender spike lavender, Lotus, Lovage root, Marigold, Marjoram, Melissa oil replacer, Mimosa, Myrtle oil replacer, Narcissus, Niaouli, Oregano, Pansy, Parsley leaf, Pine forest, Pine scotch pine, Privet, Privet blossom, Reseda, Rhubarb, Root beer, Rose geranium, Rose leaf, Rosemary, Rue, Saffron, Savin, Spruce, Sweet grass, Tansy oil replacer, Tea green tea, Thyme oil white replacer, Tomato leaf, Valerian, Violet leaf, Wintergreen, Witch hazel, Woodruff, Wormwood oil replacer, Yerba mate, Yew
Flavoring purposes Ajowan, Angelica, Artichoke, Asafoetida, Asparagus, Cajeput, Camphor tree bark, Capsicum, Caraway seed, Carrot, Carrot seed, Chervil, Cilantro, Coriander, Cubeb, Currant bud absolute replacer, Dill weed, Gin, Hyssop, Lavender flower, Lavender spike lavender, Lettuce, Lovage root, Marigold, Marjoram, Parsley leaf, Pea green pea, Pear prickly pear, Pepper bell pepper, Pine scotch pine, Rose leaf, Rue, Savin, Tansy oil replacer, Tea, Tea black tea, Tea herbal tea, Tea lemon tea, Tomato, Valerian, Vegetable, Yerba mate
Other purposes Fir, Grass, Leaf, Liverwort, Parsnip, Stem, Strawberry leaf, Tea china, Vegetation tropical hothouse vegetation, Vine, Weedy
Cosmetic purposes Perfuming agents

Safety Information

Safety information

Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined

Safety in use information

Category:
cosmetic, flavor and fragrance agents
RIFM Fragrance Material Safety Assessment: Search
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
Recommendation for acetaldehyde di-(Z)-3-hexen-1-yl acetal usage levels up to:
2.0000 % 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 Flavor Ingredient Library
publication number: 23
Click here to view publication 23
average usual ppmaverage maximum ppm
baked goods: 2.00000300.00000
beverages(nonalcoholic): 5.00000300.00000
beverages(alcoholic): --
breakfast cereal: 2.00000300.00000
cheese: 2.00000300.00000
chewing gum: 5.00000500.00000
condiments / relishes: 2.00000300.00000
confectionery froastings: 5.00000500.00000
egg products: 2.00000300.00000
fats / oils: 5.00000500.00000
fish products: --
frozen dairy: 5.00000500.00000
fruit ices: 5.00000500.00000
gelatins / puddings: 5.00000500.00000
granulated sugar: --
gravies: 5.00000500.00000
hard candy: 5.00000500.00000
imitation dairy: 5.00000500.00000
instant coffee / tea: --
jams / jellies: 5.00000500.00000
meat products: 2.00000300.00000
milk products: --
nut products: --
other grains: 5.00000500.00000
poultry: --
processed fruits: 5.00000500.00000
processed vegetables: 5.00000500.00000
reconstituted vegetables: --
seasonings / flavors: 5.00000500.00000
snack foods: 2.00000300.00000
soft candy: 5.00000500.00000
soups: 2.00000300.00000
sugar substitutes: --
sweet sauces: 5.00000500.00000

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):63449-64-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :5367767
National Institute of Allergy and Infectious Diseases:Data
(Z)-1-[1-[(Z)-hex-3-enoxy]ethoxy]hex-3-ene
Chemidplus:0063449649