Preferred name | alpha-farnesene |
Trivial Name | Farnesene |
Short Description | (3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene |
Formula | C15 H24 |
CAS Number | 502-61-4 |
Deleted CAS Number | 21499-64-9 |
FEMA Number | 3839 |
Flavis Number | 1.04 |
ECHA Number | 207-948-6 |
FDA UNII | 7E1785CZ0H |
Nikkaji Number | J47.112G |
MDL | MFCD00036650 |
COE Number | 10998 |
xLogP3-AA | 6.10 (est) |
NMR Predictor | External link |
JECFA Food Flavoring | 1343 alpha-farnesene |
FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
FDA Mainterm | 502-61-4 ; FARNESENE |
Synonyms |
|
Google Scholar | Start search |
Google Books | Start search |
Google Patents | Start search |
Perfumer & Flavorists | Start search |
EU Patents | Start search |
PubMeb | Start search |
NCBI | Start search |
(3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene | |
NIST Chemistry WebBook: | Search Inchi |
Canada Domestic Sub. List: | 502-61-4 |
Pubchem (cid): | 5281516 |
Pubchem (sid): | 134978777 |
Flavornet: | 502-61-4 |
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 |
CHEBI: | View |
CHEMBL: | View |
KEGG (GenomeNet): | C09665 |
HMDB (The Human Metabolome Database): | HMDB36066 |
FooDB: | FDB014895 |
Export Tariff Code: | 2901.29.6000 |
Typical G.C. | |
VCF-Online: | VCF Volatile Compounds in Food |
ChemSpider: | View |
Wikipedia: | View |
Material listed in food chemical codex | No |
Molecular weight | 204.35627746582 |
Specific gravity | @ 25 °C |
Pounds per Gallon | 7.023 to 7.314 |
Refractive Index | 1.49 to 1.505 @ 20 °C |
Boiling Point | 260 to 262°C @ 760 mm Hg |
Vapor Pressure | 0.01 mmHg @ 25 °C |
Flash Point TCC Value | 100 °C TCC |
logP (o/w) | 6.139 est |
Solubility | |
alcohol | Yes |
water, 0.01053 mg/L @ 25 °C (est) | Yes |
water | No |
Odor Type: Woody | |
citrus, herbal, lavender, bergamot, myrrh, neroli, green, woody, vegetable, floral | |
Luebke, William tgsc, (1996) | At 100.00 %. citrus herbal lavender bergamot myrrh neroli green |
Mosciano, Gerard P&F 25, No. 1, 49, (2000) | At 1.00 % in ethyl alcohol. Woody, green vegetative with a hint of a floral nuance. It has a slight gin herbal and citrus dry out |
Flavor Type: Green | |
fresh, green, vegetable, celery, hay, fatty, tropical, fruity | |
Mosciano, Gerard P&F 25, No. 1, 49, (2000) | At 10.00 - 20.00 ppm. Fresh green vegetative, with celery and hay nuances and somewhat fatty and tropical fruity afternotes |
Excellent for terpene notes of gin, carrot, mango, lime, herbal notes of celery, parsley. | Terpeny, herbal, slight celery notes |
(data available) |
Applications | |
Odor purposes | Bergamot, Berry, Citrus, Gardenia, Green, Herbal, Juniper berry, Lavender, Melon, Myrrh, Neroli, Raspberry, Woody |
Flavoring purposes | Gin, Tea, Tropical |
Cosmetic purposes | Fragrance, Perfuming agents |
Preferred SDS: View | |
European information : | |
Most important hazard(s): | |
None - None found. | |
S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. 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: | |
Not determined | |
Dermal Toxicity: | |
Not determined | |
Inhalation Toxicity: | |
Not determined |
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 alpha-farnesene usage levels up to: | |||
8.0000 % in the fragrance concentrate. | |||
Maximised Survey-derived Daily Intakes (MSDI-EU): | 0.61 (μg/capita/day) | ||
Maximised Survey-derived Daily Intakes (MSDI-USA): | 40.00 (μg/capita/day) | ||
Threshold of Concern: | 1800 (μg/person/day) | ||
Structure Class: | I | ||
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: 18 | |||
Click here to view publication 18 | |||
average usual ppm | average maximum ppm | ||
baked goods: | 10.00000 | 50.00000 | |
beverages(nonalcoholic): | 5.00000 | 20.00000 | |
beverages(alcoholic): | 5.00000 | 20.00000 | |
breakfast cereal: | 10.00000 | 50.00000 | |
cheese: | 2.00000 | 10.00000 | |
chewing gum: | 30.00000 | 90.00000 | |
condiments / relishes: | 5.00000 | 15.00000 | |
confectionery froastings: | 20.00000 | 60.00000 | |
egg products: | - | - | |
fats / oils: | 5.00000 | 30.00000 | |
fish products: | 1.00000 | 5.00000 | |
frozen dairy: | 5.00000 | 40.00000 | |
fruit ices: | 5.00000 | 20.00000 | |
gelatins / puddings: | 2.00000 | 10.00000 | |
granulated sugar: | - | - | |
gravies: | 5.00000 | 20.00000 | |
hard candy: | 10.00000 | 50.00000 | |
imitation dairy: | 1.00000 | 5.00000 | |
instant coffee / tea: | 5.00000 | 20.00000 | |
jams / jellies: | 2.00000 | 10.00000 | |
meat products: | 1.00000 | 5.00000 | |
milk products: | 10.00000 | 30.00000 | |
nut products: | 5.00000 | 20.00000 | |
other grains: | 10.00000 | 50.00000 | |
poultry: | 1.00000 | 5.00000 | |
processed fruits: | 5.00000 | 30.00000 | |
processed vegetables: | 2.00000 | 10.00000 | |
reconstituted vegetables: | 5.00000 | 20.00000 | |
seasonings / flavors: | 10.00000 | 50.00000 | |
snack foods: | 5.00000 | 20.00000 | |
soft candy: | 10.00000 | 30.00000 | |
soups: | 5.00000 | 20.00000 | |
sugar substitutes: | 1.00000 | 10.00000 | |
sweet sauces: | 2.00000 | 10.00000 |
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): |
Flavouring Group Evaluation 25, (FGE.25)[1] - Aliphatic and aromatic hydrocarbons from chemical group 31 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf |
Flavouring Group Evaluation 78 (FGE.78)[1] - Consideration of Aliphatic and alicyclic and aromatic hydrocarbons evaluated by JECFA (63rd meeting) structurally related to aliphatic and aromatic hydrocarbons evaluated by EFSA in FGE.25 - 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 25Rev1: Aliphatic and aromatic hydrocarbons from chemical group 31 View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 78, Revision 1 (FGE.78Rev1): Consideration of aliphatic and alicyclic and aromatic hydrocarbons evaluated by JECFA (63rd meeting) structurally related to aliphatic and aromatic hydrocarbons evaluated by EFSA in FGE.25Rev2 View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 25, Revision 2 (FGE.25Rev2): Aliphatic and aromatic hydrocarbons from chemical group 31 View page or View pdf |
Statement on List of Representative Substances for Testing. The current Statement lays down a list of substances in sub-groups with representative substances for which additional data are required prior to their evaluation through the Procedure (Regulation (EC) No 1565/2000). View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 78, Revision 2 (FGE.78Rev2): Consideration of aliphatic and alicyclic and aromatic hydrocarbons evaluated by JECFA (63rd meeting) structurally related to aliphatic hydrocarbons evaluated by EFSA in FGE.25Rev3 View page or View pdf |
EPI System: View |
AIDS Citations:Search |
Cancer Citations:Search |
Toxicology Citations:Search |
EPA Substance Registry Services (TSCA):502-61-4 |
EPA ACToR:Toxicology Data |
EPA Substance Registry Services (SRS):Registry |
Laboratory Chemical Safety Summary :5281516 |
National Institute of Allergy and Infectious Diseases:Data |
WGK Germany:3 |
(3E,6E)-3,7,11-trimethyldodeca-1,3,6,10-tetraene |
Chemidplus:0000502614 |