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3-octenoic acid

Chemical Structure

General Material Information

Preferred name 3-octenoic acid
Trivial Name 3-Octenoic acid
Short Description oct-3-enoic acid
Formula C8 H14 O2
CAS Number 1577-19-1
FEMA Number 4362
ECHA Number 216-418-3
FDA UNII 52M4D39OOY
MDL MFCD00016562
COE Number 10157
xLogP3-AA 2.30 (est)
NMR Predictor External link
JECFA Food Flavoring 1627 3-octenoic acid
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 1577-19-1 ; 3-OCTENOIC ACID
Synonyms
  • 2-heptene-1-carboxylic acid
  • oct-3-enoic acid
  • delta-3-octenoic acid
  • 2-Heptene-1-carboxylic acid
  • Δ3-Octenoic acid

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

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Literature & References

oct-3-enoic acid
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:1577-19-1
Pubchem (cid):15307
Pubchem (sid):134981190
Publications by PubMed
Improved enzymatic method for determining free fatty acids in serum, with use of 3-octenoic acid.

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):Search
FooDB:FDB009959
Export Tariff Code:2916.19.3000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 142.19798278809
Specific gravity @ 20 °C
Pounds per Gallon 7.731 to 7.814
Refractive Index 1.443 to 1.45 @ 20 °C
Boiling Point 240 to 242°C @ 760 mm Hg
Vapor Pressure 0.01 mmHg @ 25 °C
Flash Point TCC Value 141.11 °C TCC
logP (o/w) 2.363 est
Solubility
alcohol Yes
water, slightly Yes
water, 797.6 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Fatty
oily, fatty
General comment At 100.00 %. oily fatty

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 3-octenoic acid 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: 23
Click here to view publication 23
average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): --
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: 2.0000010.00000
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: 0.500002.50000
instant coffee / tea: --
jams / jellies: --
meat products: 0.500002.50000
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 5.0000025.00000
snack foods: 1.000005.00000
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --

Safety references

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):1577-19-1
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :15307
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3265
WGK Germany:1
oct-3-enoic acid
Chemidplus:0001577191
RTECS:RH0175000 for cas# 1577-19-1