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General Material Information

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
  • 2-butyloct-2-enal
  • 2-hexylidene hexanal
  • 2-hexylidenehexanal
  • oct-2-enal, 2-butyl-
  • 2-octenal, 2-butyl-

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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):HMDB38972
FooDB:FDB021773
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

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

Organoleptic Properties

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

Occurrences

Safety Information

Safety information

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

Safety in use information

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 ppmaverage 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: 0.002000.01000
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: 0.050000.10000
soft candy: --
soups: 0.100000.50000
sugar substitutes: --
sweet sauces: --

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
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