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jasmin pyranone

Chemical Structure

General Material Information

Preferred name jasmin pyranone
Trivial Name 6-(3Z)-3-Hexen-1-yltetrahydro-2H-pyran-2-one
Short Description 5-hydroxy-8-undecenoic acid delta-lactone
Formula C11 H18 O2
CAS Number 68959-28-4
FEMA Number 3758
Flavis Number 10.035
ECHA Number 273-411-8
FDA UNII 3WL5LFE5RZ
COE Number 11198
xLogP3-AA 2.70 (est)
NMR Predictor External link
JECFA Food Flavoring 248 5-hydroxy-8-undecenoic acid delta-lactone
FDA Patent No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm 68959-28-4 ; 5-HYDROXY-8-UNDECENOIC ACID DELTA-LACTONE
Synonyms
  • 6-[(Z)- hex-3-enyl]oxan-2-one
  • hexenyl tetrahydropyranone
  • (Z)-6-(3-hexenyl) tetrahydro-2H-pyran-2-one
  • cis-6-(3-hexenyl) tetrahydro-2H-pyran-2-one
  • (Z)-6-(3-hexenyl)tetrahydro-2H-pyran-2-one
  • 5-hydroxy-8-undecenoic acid delta-lactone
  • 5-hydroxy-cis-8-undecenoic acid delta-lactone
  • 5-hydroxy-cis-8-undecenoic acid lactone
  • jasmine pyranone
  • jasmolactone extra C
  • undec-8-eno-1,5-lactone
  • delta-cis-8-undecene lactone
  • 6-[(Z)-hex-3-enyl]oxan-2-one
  • 2H-Pyran-2-one, 6-(3Z)-3-hexen-1-yltetrahydro-
  • 2H-Pyran-2-one, 6-(3-hexenyl)tetrahydro-, (Z)-
  • 2H-Pyran-2-one, 6-(3Z)-3-hexenyltetrahydro-
  • 6-(3Z)-3-Hexen-1-yltetrahydro-2H-pyran-2-one

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):HMDB37829
FooDB:FDB016978
Export Tariff Code:2932.29.6000
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View

PhysChem Properties

Material listed in food chemical codex No
Molecular weight 182.26286315918
Specific gravity @ 25 °C
Pounds per Gallon 8.113 to 8.238
Refractive Index 1.473 to 1.48 @ 20 °C
Vapor Pressure 0.001 mmHg @ 25 °C
Vapor Density 1
Flash Point TCC Value 104.44 °C TCC
logP (o/w) 2.498 est
Solubility
alcohol Yes
water, 200.3 mg/L @ 25 °C (est) Yes
water No

Organoleptic Properties

Odor Type: Floral
creamy, fruity, peach, plum, dairy, coconut, buttery, sweet, milky
Odor strength medium
Substantivity 340 hour(s) at 100.00 %
Luebke, William tgsc, (1986) At 100.00 %. creamy fruity peach plum dairy coconut buttery
Mosciano, Gerard P&F 18, No. 1, 43, (1993) Creamy, sweet, fruity peach, milky, dairy with a coconut nuance
Flavor Type: Creamy
creamy, waxy, sweet, fatty, fruity, peach, coconut
Mosciano, Gerard P&F 18, No. 1, 43, (1993) At 30.00 ppm. Creamy, waxy, sweet fatty with a fruity peach and coconut nuance
Nice coconut, dairy type lactone. Good for creamy coconut and other sweet dairy flavor notes. Sweet, dairy lactone note, creamy, coconut

Occurrences

Safety Information

Safety information

Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
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)
None found.
GHS Label elements, including precautionary statements
Pictogram
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-mouse LD50 > 5000 mg/kg
Nice coconut, dairy type lactone. Good for creamy coconut and other sweet dairy flavor notes.

Dermal Toxicity:
skin-guinea pig LD50 > 5000 mg/kg
Nice coconut, dairy type lactone. Good for creamy coconut and other sweet dairy flavor notes.

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 jasmin pyranone usage levels up to:
2.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.012 (μg/capita/day)
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: 15
Click here to view publication 15
average usual ppmaverage maximum ppm
baked goods: -3.00000
beverages(nonalcoholic): -3.00000
beverages(alcoholic): -5.00000
breakfast cereal: --
cheese: --
chewing gum: -15.00000
condiments / relishes: --
confectionery froastings: -3.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: -10.00000
fruit ices: -0.10000
gelatins / puddings: -3.00000
granulated sugar: --
gravies: --
hard candy: -10.00000
imitation dairy: -1.00000
instant coffee / tea: --
jams / jellies: -3.00000
meat products: --
milk products: -2.00000
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: -1.50000
soups: --
sugar substitutes: --
sweet sauces: -3.00000

Safety references

European Food Safety Athority(EFSA):Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...

European Food Safety Authority (EFSA) reference(s):

Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission related to - Flavouring Group Evaluation 10: Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - (Commission Regulation (EC) No 1565/2000 of 18 July 2000)
View page or View pdf

Flavouring Group Evaluation 10, Revision 1 (FGE10 Rev1)[1] - Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food (AFC)
View page or View pdf

Scientific Opinion on Flavouring Group Evaluation 10, Revision 2 (FGE.10Rev2): Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30
View page or View pdf

EPI System: View
AIDS Citations:Search
Cancer Citations:Search
Toxicology Citations:Search
EPA Substance Registry Services (TSCA):68959-28-4
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :11969488
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:2
6-[(Z)-hex-3-enyl]oxan-2-one
Chemidplus:0068959284