| Preferred name | bisabolene |
| Trivial Name | γ-Bisabolene |
| Short Description | 1,4(8),12-bisabolatriene |
| Formula | C15 H24 |
| CAS Number | 495-62-5 |
| Deleted CAS Number | 11003-31-9 |
| FEMA Number | 3331 |
| Flavis Number | 1.016 |
| ECHA Number | 207-805-8 |
| FDA UNII | E6941S3U3Q |
| Nikkaji Number | J1.590.260D |
| Beilstein Number | 2501191 |
| MDL | MFCD00129080 |
| COE Number | 10979 |
| xLogP3-AA | 4.70 (est) |
| NMR Predictor | External link |
| JECFA Food Flavoring | 1336 bisabolene |
| FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm | 495-62-5 ; BISABOLENE |
| Synonyms |
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| 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 |
| 1-methyl-4-(6-methylhept-5-en-2-ylidene)cyclohexene | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 495-62-5 |
| Pubchem (cid): | 62346 |
| Pubchem (cas): | 495-62-5 |
| (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 |
| KEGG (GenomeNet): | C16814 |
| HMDB (The Human Metabolome Database): | HMDB36154 |
| FooDB: | FDB015018 |
| Export Tariff Code: | 2902.19.0000 |
| 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 |
| Boiling Point | 261 to 263°C @ 760 mm Hg |
| Vapor Pressure | 0.03 mmHg @ 20 °C |
| Flash Point TCC Value | 110 °C TCC |
| logP (o/w) | 6.704 est |
| Solubility | |
| alcohol | Yes |
| water, 0.008994 mg/L @ 25 °C (est) | Yes |
| water | No |
| Stability | |
| bath foam | Unspecified |
| hair spray | Unspecified |
| soap | Unspecified |
| Odor Type: Fruity | |
| balsamic, citrus, myrrh, opoponax, spicy, woody, fruity, tropical, terpenic, green, banana | |
| Odor strength | medium |
| Substantivity | 104 hour(s) at 100.00 % |
| Luebke, William tgsc, (1985) | At 100.00 %. balsamic citrus myrrh opoponax spicy |
| Mosciano, Gerard P&F 20, No. 4, 23, (1995) | Woody, citrus, valencene, fruity, tropical, terpy, green and banana |
| Flavor Type: Citrus | |
| citrus, woody, tropical, floral, fruity, astringent, green | |
| Mosciano, Gerard P&F 20, No. 4, 23, (1995) | At 30.00 ppm. Citrus, woody, tropical, floral, fruity, astringent and green |
| Used in lemon, lime, green apple, sherry, pineapple and berry flavors. | Berry |
| General comment | , spicy and citrus note; tropical, floral, fruity, astringent and green |
| (data available) |
| Applications | |
| Odor purposes | Apple green apple , Balsam , Banana , Bergamot , Berry , Cardamom oil replacer , Citrus , Fir needle oil replacer , Floral , Fruit , Grapefruit , Lemon , Lime , Mandarin , Myrrh , Opoponax , Orange , Orange blossom , Oriental , Pear , Pineapple , Spice , Woody |
| Flavoring purposes | Tropical |
| Cosmetic purposes | Perfuming agents |
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
| R 36 - Irritating to eyes. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/39 - Wear suitable clothing and eye/face protection. | |
| 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. | |
| Human Experience: | |
| 10 % solution: no irritation or sensitization. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 > 5000 mg/kg Food and Cosmetics Toxicology. Vol. 13, Pg. 725, 1975. | |
| Dermal Toxicity: | |
| skin-rabbit LD50 > 5000 mg/kg Food and Cosmetics Toxicology. Vol. 13, Pg. 725, 1975. | |
| 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 bisabolene usage levels up to: | |||
| 10.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 13.00 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 10.00 (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: 6 | |||
| Click here to view publication 6 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 5.00000 | |
| beverages(nonalcoholic): | - | 3.00000 | |
| beverages(alcoholic): | - | 3.00000 | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | - | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 3.00000 | |
| fruit ices: | - | 3.00000 | |
| gelatins / puddings: | - | 3.00000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 5.00000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | - | 3.00000 | |
| meat products: | - | - | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | - | - | |
| soft candy: | - | - | |
| soups: | - | - | |
| sugar substitutes: | - | - | |
| sweet sauces: | - | - | |
| 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 |
| Scientific Opinion on the safety and efficacy of aliphatic and aromatic hydrocarbons (chemical group 31) when used as flavourings for all animal species 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):495-62-5 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :62346 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| 1-methyl-4-(6-methylhept-5-en-2-ylidene)cyclohexene |
| Chemidplus:0000495625 |
| RTECS:GW6060000 for cas# 495-62-5 |