Preferred name | 2-butyl-2-octenal |
Trivial Name | 2-butyloct-2-enal |
Short Description | 2-hexylidenehexanal |
Formula | C12 H22 O |
CAS Number | 13019-16-4 |
FEMA Number | 4616 |
FDA UNII | 49D14RAJ7M |
Nikkaji Number | J450.280I |
MDL | MFCD23701665 |
xLogP3-AA | 4.50 (est) |
NMR Predictor | External link |
FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
FDA Mainterm | 13019-16-4 ; 2-HEXYLIDENEHEXANAL |
Synonyms |
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Perfumer & Flavorists | Start search |
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2-butyloct-2-enal | |
NIST Chemistry WebBook: | Search Inchi |
Pubchem (cid): | 5352696 |
Pubchem (sid): | 134989587 |
Pherobase: | View |
(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): | HMDB38972 |
FooDB: | FDB021773 |
VCF-Online: | VCF Volatile Compounds in Food |
ChemSpider: | View |
Alfrebro | Axsyn |
Beijing Lys Chemicals | Parchem |
Penta International | Sigma-Aldrich |
Alfrebro LLC/ Archer Daniels Midland Company | Penta International Corporation |
Material listed in food chemical codex | No |
Molecular weight | 182.30653381348 |
Specific gravity | @ 25 °C |
Pounds per Gallon | 6.99 to 7.073 |
Refractive Index | 1.456 to 1.46 @ 20 °C |
Melting Point | 132 to 133°C @ 760 mm Hg |
Boiling Point | 262 to 264°C @ 760 mm Hg |
Vapor Pressure | 0.011 mmHg @ 25 °C |
Flash Point TCC Value | 160 °C TCC |
logP (o/w) | 4.756 est |
Shelf life | 24 months (or longer if stored properly.) |
Solubility | |
alcohol | Yes |
water, 6.5 mg/L @ 25 °C (est) | Yes |
water | No |
Odor Type: Green | |
aldehydic, green, watery, fruity, metallic, oily, tropical, fatty, sweaty, goaty | |
Odor strength | medium |
Substantivity | 79 hour(s) at 100.00 % |
Luebke, William tgsc, (2021) | At 100.00 %. aldehydic green watery fruity metallic oily tropical fatty sweaty goaty |
Flavor Type: Green | |
green, vegetable, leafy, cucumber, oily, herbal, fatty, watercress, violet | |
Luebke, William tgsc, (2021) | Green vegetable leafy cucumber oily herbal fatty watercress violet |
(data available) |
Preferred SDS: View | |
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 |
Category: | |||
flavoring agents | |||
Recommendation for 2-butyl-2-octenal usage levels up to: | |||
not for fragrance use. | |||
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: 24 | |||
Click here to view publication 24 | |||
average usual ppm | average maximum ppm | ||
baked goods: | - | - | |
beverages(nonalcoholic): | - | - | |
beverages(alcoholic): | - | - | |
breakfast cereal: | - | - | |
cheese: | - | - | |
chewing gum: | - | - | |
condiments / relishes: | - | - | |
confectionery froastings: | - | - | |
egg products: | - | - | |
fats / oils: | - | - | |
fish products: | - | - | |
frozen dairy: | - | - | |
fruit ices: | - | - | |
gelatins / puddings: | - | - | |
granulated sugar: | - | - | |
gravies: | - | - | |
hard candy: | - | - | |
imitation dairy: | - | - | |
instant coffee / tea: | - | - | |
jams / jellies: | - | - | |
meat products: | 0.00200 | 0.01000 | |
milk products: | - | - | |
nut products: | - | - | |
other grains: | - | - | |
poultry: | - | - | |
processed fruits: | - | - | |
processed vegetables: | - | - | |
reconstituted vegetables: | - | - | |
seasonings / flavors: | - | - | |
snack foods: | 0.05000 | 0.10000 | |
soft candy: | - | - | |
soups: | 0.10000 | 0.50000 | |
sugar substitutes: | - | - | |
sweet sauces: | - | - |
EPI System: View |
AIDS Citations:Search |
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EPA ACToR:Toxicology Data |
EPA Substance Registry Services (SRS):Registry |
Laboratory Chemical Safety Summary :5352696 |
National Institute of Allergy and Infectious Diseases:Data |
2-butyloct-2-enal |
Chemidplus:0013019164 |