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  1. 1.
    General Material Information
  2. 2.
    PhysChem Properties
  3. 3.
    Occurrences
  4. 4.
    Organoleptic Properties
  5. 5.
    Suppliers
  6. 6.
    Potential Uses
  7. 7.
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    Literature & References

adoxal (Givaudan)

Chemical Structure

General Material Information

Preferred name adoxal (Givaudan)
Trivial Name Adoxal
Short Description farenal (Symrise)
Formula C14 H26 O
CAS Number 141-13-9
FEMA Number 4768
ECHA Number 205-460-8
FDA UNII JNM5JFE28J
Nikkaji Number J12.264E
xLogP3-AA 5.00 (est)
NMR Predictor External link
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
Synonyms
  • adoxlin
  • doxal
  • farenal (Symrise)
  • 2,6,10-trimethyl undec-9-enal
  • trimethyl undecenal
  • trimethyl undecylenic aldehyde
  • 2,6,10-trimethyl-9-undecen-1-al
  • 2,6,10-trimethyl-9-undecenal
  • 2,6,10-trimethylundec-9-enal
  • 9-undecenal, 2,6,10-trimethyl-
  • waxy aldehyde
  • 2,6,10-trimethylundec-9-enal
  • 9-Undecenal, 2,6,10-trimethyl-
  • 2,6,10-Trimethyl-9-undecenal
  • Adoxal
  • 2,6,10-Trimethyl-9-undecen-1-al
  • NSC 122698
  • Farenal

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

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Literature & References

2,6,10-trimethylundec-9-enal
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:141-13-9
Pubchem (cid):98403
Pubchem (sid):135057671
Pherobase:View
Publications by Info
Adoxal

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
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2912.19.20
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 210.36041259766
Specific gravity @ 25 °C
Pounds per Gallon 7.04 to 7.089
Refractive Index 1.45 to 1.455 @ 20 °C
Boiling Point 286 to 287°C @ 760 mm Hg
Vapor Pressure 0.003 mmHg @ 25 °C
Flash Point TCC Value 93.33 °C TCC
logP (o/w) 5.196 est
Solubility
alcohol Yes
water, 3 mg/L @ 20 °C (exp) Yes
Stability
alcoholic - good Unspecified
antiperspirant spray - poor Unspecified
APC (pH = 10) - good Unspecified
candles - good Unspecified
damp fabric - moderate Unspecified
dry fabric - poor Unspecified
liquid bleach - poor Unspecified
pH = 2 - moderate Unspecified
powder detergent - moderate Unspecified
powder detergent + activator - poor Unspecified
soap - good Unspecified
toiletries - good Unspecified

Organoleptic Properties

Odor Type: Aldehydic
fresh, aldehydic, floral, waxy, watery, marine, rose, lily of the valley, incense
Odor strength high , recommend smelling in a 1.00 % solution or less
Substantivity 168 hour(s) at 100.00 %
Luebke, William tgsc, (1986) At 1.00 % in dipropylene glycol. fresh aldehydic floral waxy watery
Flavor Type: Waxy
waxy, aldehydic, floral, nasturtium, soapy, watery, metallic
Luebke, William tgsc, (1986) Waxy aldehydic floral nasturtium soapy watery metallic

Potential Uses

Applications
Odor purposes Acacia, Agrumen aldehyde, Aldehydic, Allspice, Almond blossom, Amber, Animal, Apple blossom, Crabapple, Ash mountain ash, Azalea, Balsam, Bark, Bayberry, Beeswax absolute replacer, Boronia, Bouquet, Cedar forest, Cedrat, Champaca, Cherry black cherry, Cherry blossom, Christmas, Chypre, Citronella, Citrus, Civet, Clover, Colonia, Cortex, Cotton candy, Country meadow, Crabapple blossom, Currant, Eglantine, Elder berry, Elder flower, Evergreen, Fern, Fig, Fir balsam, Fir needle oil replacer, Floral, Foliage, Frangipani plumeria, Freesia, Fresh and clean, Galangal root, Gardenia, Ginger white ginger, Green, Guaiacwood, Gurjun balsam, Heather, Herbal, Hibiscus, Hollyberry, Honeysuckle, Hydrangea, Incense, Jasmin, Kewda, Kiwi blossom, Kumquat, Lavender, Lemon, Lily, Lily of the valley, Lime, Linden flower, Lotus, Lychee, Magnolia, Maja, Mango flower, Melon, Millefleurs, Mimosa, Moss, Mulberry, Musk, Ocean sea, Orange, Orange blossom, Orchid, Orris, Pansy, Papaya, Passion blossom, Passion fruit, Pear, Pear blossom, Peony, Petunia, Pine, Pineapple, Pinion, Plum blossom, Poppy, Quince, Rain, Redwood, Reseda, Rhubarb, Rose, Rose tea rose, Rose white rose, Saffron, Sandalwood, Sap, Savin, Scented stock, Soapy sandalwood moss, Spice, Sweet grass, Tobacco, Toffee, Valerian, Violet, Wallflower, Woody
Flavoring purposes Caramel, Chocolate cocoa, Fruit tropical fruit, Galangal root, Guaiacwood, Marshmallow, Pear prickly pear, Savin, Starfruit, Tropical, Valerian
Other purposes Blossom tropical blossom, Clean, Dewy, Fantasy blends, Natural, Petal waxy petal, Rose wild rose, Watery, Waxy, Weedy, Wet fields
Cosmetic purposes Perfuming agents

Safety Information

Safety information

European information :
Most important hazard(s):
Xi - Irritant
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
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.
Hazards identification
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
Acute aquatic toxicity (Category 1), H400
Chronic aquatic toxicity (Category 1), H410
GHS Label elements, including precautionary statements
Pictogramenvironment.jpg
Signal word Warning
Hazard statement(s)
H400 - Very toxic to aquatic life
H410 - Very toxic to aquatic life with long lasting effects
Precautionary statement(s)
P273 - Avoid release to the environment.
P391 - Collect spillage. Hazardous to the aquatic environment
P501 - Dispose of contents/ container to an approved waste disposal plant.
Oral/Parenteral Toxicity:
oral-rat LDLo 5000 mg/kg
Food and Chemical Toxicology. Vol. 30(Suppl), Pg. 133S, 1992.

Dermal Toxicity:
skin-rabbit LD50 > 5000 mg/kg
Food and Chemical Toxicology. Vol. 30(Suppl), Pg. 133S, 1992.

Inhalation Toxicity:
Not determined

Safety in use information

Category:
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 adoxal (Givaudan) usage levels up to:
5.0000 % 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: 26
Click here to view publication 26
average usual ppmaverage maximum ppm
baked goods: 0.200001.00000
beverages(nonalcoholic): 0.200001.00000
beverages(alcoholic): 0.200001.00000
breakfast cereal: 0.200001.00000
cheese: 0.200001.00000
chewing gum: 0.400001.50000
condiments / relishes: 0.200001.00000
confectionery froastings: 0.020001.00000
egg products: 0.020001.00000
fats / oils: 0.020001.00000
fish products: 0.020001.00000
frozen dairy: 0.002001.00000
fruit ices: 0.200001.00000
gelatins / puddings: 0.200001.00000
granulated sugar: 0.200001.00000
gravies: 0.200001.00000
hard candy: 0.200001.00000
imitation dairy: 0.200001.00000
instant coffee / tea: 0.200001.00000
jams / jellies: 0.200001.00000
meat products: 0.200001.00000
milk products: 0.200001.00000
nut products: 0.200001.00000
other grains: 0.200001.00000
poultry: 0.200001.00000
processed fruits: 0.200001.00000
processed vegetables: 0.200001.00000
reconstituted vegetables: 0.200001.00000
seasonings / flavors: 0.200001.00000
snack foods: 0.200001.00000
soft candy: 0.200001.00000
soups: 0.200001.00000
sugar substitutes: 0.200001.00000
sweet sauces: 0.200001.00000

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):141-13-9
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :98403
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
2,6,10-trimethylundec-9-enal
Chemidplus:0000141139