beta-bisabolene

(1R)-bisabola-4,7(11),10(15)-triene

CAS: 495-61-4 C15 H24 MW: 204.35628000 balsamic

Identification

Namebeta-bisabolene
IUPAC(4R)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene
CAS Number495-61-4
FDA UNIIS19BRC22QA
Molecular FormulaC15 H24
Molecular Weight204.35628000
Nikkaji NumberJ677.682E

Regulatory

DG SANTE Food Flavourings01.028 beta-bisabolene
FEMA Number4940
FDANo longer provide for the use of these seven synthetic flavoring substances

Physical Properties

Appearance colorless clear liquid (est)
Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.87900 to 0.88500 @ 25.00 °C.
Pounds per Gallon - (est). 7.314 to 7.364
Refractive Index 1.48900 to 1.49500 @ 20.00 °C.
Boiling Point 129.00 to 130.00 °C. @ 10.50 mm Hg, 274.00 to 275.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.009000 mmHg @ 25.00 °C. (est)
Flash Point 229.00 °F. TCC ( 109.44 °C. )
logP (o/w) 6.439 (est)
Soluble in alcohol
Insoluble in water

Organoleptic Properties

Odor Description at 100.00 %.

Safety Information

Oral/Parenteral Toxicityoral-rat LD50 > 5000 mg/kg
Dermal ToxicityNot determined
Inhalation ToxicityNot determined

GHS Classification

['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']

Safety in Use

Categoryflavor and fragrance agents
RIFM Fragrance Material Safety AssessmentSearch
Recommendation for beta-bisabolene usage levels up to6.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU)2.70 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI)3900 (μg/person/day)
Threshold of Concern1800 (μg/person/day)
Structure ClassI
baked goods10.00000
beverages(nonalcoholic)5.00000
beverages(alcoholic)10.00000
breakfast cereal5.00000
cheese-
chewing gum10.00000
condiments / relishes-
confectionery froastings10.00000
egg products-
fats / oils5.00000
fish products-
frozen dairy7.00000
fruit ices10.00000
gelatins / puddings5.00000
granulated sugar-
gravies-
hard candy10.00000
imitation dairy-
instant coffee / tea-
jams / jellies5.00000
meat products-
milk products-
nut products-
other grains-
poultry-
processed fruits7.00000
processed vegetables-
reconstituted vegetables-
seasonings / flavors-
snack foods-
soft candy10.00000
soups-
sugar substitutes-
sweet sauces5.00000
Dairy products, excluding products of category 02.0 (01.0)7.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0)5.00000
Edible ices, including sherbet and sorbet (03.0)10.00000
Processed fruit (04.1)7.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2)-
Confectionery (05.0)10.00000
Chewing gum (05.3)-
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0)5.00000
Bakery wares (07.0)10.00000
Meat and meat products, including poultry and game (08.0)2.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0)2.00000
Eggs and egg products (10.0)-
Sweeteners, including honey (11.0)-
Salts, spices, soups, sauces, salads, protein products, etc. (12.0)5.00000
Foodstuffs intended for particular nutritional uses (13.0)10.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1)5.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2)10.00000
Ready-to-eat savouries (15.0)20.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0)5.00000

Chemical sources Association Inc

Exchange of knowledge

Need This Item for Flavor? You can contact the Chemical Sources Association.

Indukern, S.A. F&F Ingredients Division

Commitment to quality

Idukern F&F Ingredients is your partner for the fragrance and flavor ingredients.

View All Website +34 93 506 91 00 info@indukern.es

Ernesto Ventós S.A.

Leaders in essence

We employ our five senses to do our job well.

View All Website +1 856 226 7501 info@ventos.com

Potential Uses

FR balsam

Natural Occurrence

alpinia galanga oil @ 16.20% Data amyris wood oil @ 1.60% Data angelica seed oil CO2 extract @ trace% Data anise oil anise seed oil anise seed oil star china @ 0.22% Data anise star anise fruit anise tissue culture artichoke - 0.003 mg/kg baccharis coridifolia oil argentina @ 0.40% Data basil plant basil shoot oil bay laurel leaf bergamot oil @ 0.212-0.648% Data bergamot oil @ 0.6% Data calamus leaf oil @ 0.21% Data carrot - 1.18 mg/kg carrot root carrot seed carrot seed oil @ 0.23% Data carrot seed oil @ 34.70% Data carrot shoot cedarwood oil china @ 0.40% Data chamomile garden chamomile plant cinnamomum fragrans baillon leaf oil madagascar @ 0.20% Data cochlospermum planchonii oil @ 0.20% Data cumin seed fennel flower oil bitter lithuania @ 0.15% Data fleabane oil @ 0.20% Data galangal root oil @ 0.21% Data ginger rhizome ginger rhizome oil ginger root oil brazil @ 4.70% Data ginger root oil china @ 13.49% Data ginger root oil CO2 extract @ 3.53% Data ginger root oil CO2 extract australia @ 2.73% Data guava fruit - 0.0003 mg/kg guava fruit oil reunion @ 0.50% Data guava leaf oil cuba @ 0.40% Data guava pericarp oil helichrysum italicum oil america @ 0.25% Data jambu flower oil brazil @ 2.70% Data lavender oil spike spain @ 0.24% Data lemon leaf oil lemon oil lemon oil california @ 0.55% Data lemon oil expressed italy @ 37.10% Data lemon petiole lemon verbena oil turkey @ 0.15% Data lemongrass oil @ 0.08% Data lime fruit lime oil distilled mexico @ 1.04% Data lime oil expressed florida @ 0.8% Data lippia alnifolia schau. leaf oil brazil @ 0.30% Data mace - trace amount mandarin marjoram oil sweet cuba @ trace% Data marjoram oil sweet cyprus @ 0.30-1.00% Data marjoram oil sweet iran @ 2.80% Data marjoram pot oil turkey @ 0.17-1.03% Data nutmeg - trace amount nutmeg oil orange oregano oil oregano oil mexico @ 0.20% Data oregano plant oregano plant oregano shoot oregano shoot oil parsley - 33.3 mg/kg parsley leaf parsley leaf oil @ 0.41% Data parsley leaf oil egypt @ 0.21% Data parsley seed parsley seed oil @ 0.07% Data parsnip root pepper black pepper fruit pepper black pepper fruit oil pepper black pepper seed oil persea americana mill. fruit oil cuba @ 15.90% Data phlomis fruticosa l. flower oil greece @ 0.40% Data pine needle oil scotch siberia @ 0.2-1.2% Data rosemary rosemary oil CO2 extract @ 0.41% Data rosemary oil france @ 0.00-trace% Data rosemary oil morocco @ 0.06-0.13% Data sage oil spain @ 0.0-0.2% Data salvia officinalis seed oil tunisia @ 0.72% Data salvia verbenaca seed oil tunisia @ 1.10% Data sandalwood oil east indian @ 0.07% Data satureja khuzistanica jamzad oil iran @ 0.30% Data savory oil summer @ 0.85-0.93% Data savory winter savory plant sugandha kokila berry oil @ 1.10% Data tagete oil CO2 extract @ 0.08% Data thyme oil portuguese @ trace% Data thyme oil wild or creeping canada @ 3.70% Data thyme oil wild or creeping finland @ 1.90% Data thymus richardii pers. subsp. nitidus (guss.) jalas oil italy @ 32.30% Data turmeric rhizome turmeric root oil vietnam @ 0.20% Data valerian root oil @ 0.2-0.8% Data

Synonyms

(1R)- bisabola-4,7(11),10(15)-triene (-)-beta- bisabolene b- bisabolene 6- methyl-2-(4-methyl-3-cyclohexen-1-yl)-1,5-heptadiene (S)-1- methyl-4-(5-methyl-1-methylene-4-hexenyl) cyclohexene (4R)-1- methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene (4R)-1- methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene PubMed: Infection of Corn Ears by Fusarium spp. Induces the Emission of Volatile Sesquiterpenes. PubMed: A seco-laurane sesquiterpene and related laurane derivatives from the red alga Laurencia okamurai Yamada. PubMed: Isolation of jasmonate-induced sesquiterpene synthase of rice: product of which has an antifungal activity against Magnaporthe oryzae. PubMed: Chemical composition, antioxidant, anti-inflammatory and anti-proliferative activities of essential oils of plants from burkina faso. PubMed: Chemical composition of the tuber essential oil from Helianthus tuberosus L. (Asteraceae). PubMed: Variation of the chemical composition and antimicrobial activity of the essential oils of natural populations of Tunisian Daucus carota L. (Apiaceae). PubMed: Chemical composition, larvicidal action, and adult repellency of Thymus magnus against Aedes albopictus. PubMed: Variability in the essential-oil composition of Sideritis scardica GRISEB. from native Bulgarian populations. PubMed: Suites of terpene synthases explain differential terpenoid production in ginger and turmeric tissues. PubMed: Study on the volatile oil contents of Annona glabra L., Annona squamosa L., Annona muricata L. and Annona reticulata L., from Vietnam. PubMed: Differences in the volatile compositions of ginseng species (Panax sp.). PubMed: Chemotypification of Astrantia major L. (Apiaceae): essential-oil and lignan profiles of fruits. PubMed: Comparative study of the chemical composition and biological activities of Magnolia grandiflora and Magnolia virginiana flower essential oils. PubMed: A single amino acid determines the site of deprotonation in the active center of sesquiterpene synthases SbTPS1 and SbTPS2 from Sorghum bicolor. PubMed: Composition and antioxidant activities of leaf and root volatile oils of Morinda lucida. PubMed: Chemical composition and biological activity of the volatile extracts of Achillea millefolium. PubMed: Chemical composition and antioxidant activities of essential oils and methanol extracts of three wild Lavandula L. species. PubMed: Comparison of headspace solid-phase microextraction with conventional extraction for the analysis of the volatile components in Melia azedarach. PubMed: Chemical composition of the essential oil of aerial parts of Haussknechtia elymaitica Boiss. from Iran: a good natural source for trans-asaron. PubMed: Dynamic evolution of herbivore-induced sesquiterpene biosynthesis in sorghum and related grass crops. PubMed: Identification of essential oil components of Marrubium thessalum Boiss. & Heldr., growing wild in Greece. PubMed: Biosynthesis of sesquiterpenes by the fungus Fusarium verticillioides. PubMed: Chemical composition and larvicidal activity of Blumea densiflora essential oils against Anopheles anthropophagus: a malarial vector mosquito. PubMed: Chemical variability of Copaifera reticulata Ducke oleoresin. PubMed: Inter-population variability of terpenoid composition in leaves of Pistacia lentiscus L. from Algeria: a chemoecological approach. PubMed: Composition of the essential oil of Bidens tripartita L. roots and its antibacterial and antifungal activities. PubMed: Pharmacological evaluation of Copaifera multijuga oil in rats. PubMed: Free Radical Scavenging Potential and Essential Oil Composition of the Dorema glabrum Fisch. C.A. Mey Roots from Iran. PubMed: Essential oil polymorphism of wild growing Hungarian thyme (Thymus pannonicus) populations in the Carpathian Basin. PubMed: Antiplasmodial volatile extracts from Cleistopholis patens Engler & Diels and Uvariastrum pierreanum Engl. (Engl. & Diels) (Annonaceae) growing in Cameroon. PubMed: Chemical composition and antibacterial activity of essential oils of Lantana camara, Ageratum houstonianum and Eupatorium adenophorum. PubMed: Sesquiterpene synthases Cop4 and Cop6 from Coprinus cinereus: catalytic promiscuity and cyclization of farnesyl pyrophosphate geometric isomers. PubMed: Essential oil variation among natural populations of Lavandula multifida L. (Lamiaceae). PubMed: Cloning and characterization of a novel gene that encodes (S)-beta-bisabolene synthase from ginger, Zingiber officinale. PubMed: [Study on the volatile oil of Murraya exotica]. PubMed: Chemical composition and antioxidant activities of the essential oil and methanol extracts of Psammogeton canescens. PubMed: Chemical composition of the essential oils from the roots of Erigeron acris L. and Erigeron annuus (L.) Pers. PubMed: [Analysis of volatile and non-volatile compositions in ginger oleoresin by gas chromatography-mass spectrometry]. PubMed: Enrichment of the thymoquinone content in volatile oil from Satureja montana using supercritical fluid extraction. PubMed: Antioxidant, alpha-amylase inhibitory and brine-shrimp toxicity studies on Centaurea centaurium L. methanolic root extract. PubMed: Chemical characterization and biological activity of essential oils from Daucus carota L. subsp. carota growing wild on the Mediterranean coast and on the Atlantic coast. PubMed: Analysis of volatiles in dehydrated carrot samples by solid-phase microextraction followed by GC-MS. PubMed: Overexpression of the lemon basil alpha-zingiberene synthase gene increases both mono- and sesquiterpene contents in tomato fruit. PubMed: Protonation of a neutral (S)-beta-bisabolene intermediate is involved in (S)-beta-macrocarpene formation by the maize sesquiterpene synthases TPS6 and TPS11. PubMed: Antimicrobial activity of essential oils of Ocimum gratissimum L. From different populations of Kenya. PubMed: [Analysis of volatile oil in herb of pimpinella candolleana by SPME-GC-MS]. PubMed: Variability of the needle essential oils of Pinus heldreichii from different populations in Montenegro and Serbia. PubMed: Synergistic bactericidal activity of Eremanthus erythropappus oil or beta-bisabolene with ampicillin against Staphylococcus aureus. PubMed: Quantitative co-occurrence of sesquiterpenes; a tool for elucidating their biosynthesis in Indian sandalwood, Santalum album. PubMed: Quantitative determination of eight components in rhizome (Jianghuang) and tuberous root (Yujin) of Curcuma longa using pressurized liquid extraction and gas chromatography-mass spectrometry. PubMed: Bisabolanes from the red alga Laurencia scoparia. PubMed: Changes in terpene content in milk from pasture-fed cows. PubMed: Essential oil composition of diploid and tetraploid clones of ginger (Zingiber officinale Roscoe) grown in Australia. PubMed: Analysis by gas chromatography-mass spectrometry of the essential oils from the aerial parts of Pimpinella anagodendron Bolle and Pimpinella rupicola Svent., two endemic species to the Canary Islands, Spain. PubMed: Chemical composition, antimicrobial and antioxidant activity of the essential oil of Teucrium marum (Lamiaceae). PubMed: Composition and antibacterial activity of essential oil of Lantana achyranthifolia Desf. (Verbenaceae). PubMed: Chemical composition and in vitro antimicrobial activities of the essential oils from endemic Psiadia species growing in mauritius. PubMed: Essential oil composition of aerial parts of Angelica glauca growing wild in North-West Himalaya (India). PubMed: The sesquiterpene hydrocarbons of maize (Zea mays) form five groups with distinct developmental and organ-specific distributions. PubMed: Analysis by gas chromatography-mass spectrometry of the essential oil from the aerial parts of Pimpinella junoniae Ceb. & Ort., gathered in La Gomera, Canary Islands, Spain. PubMed: Essential oils from two endemic species of Apiaceae from Iran. PubMed: Changes in volatile compounds of carrots (Daucus carota L.) during refrigerated and frozen storage. PubMed: Analysis of some Italian lemon liquors (limoncello). PubMed: Evidence for differential folding of farnesyl pyrophosphate in the active site of aristolochene synthase: a single-point mutation converts aristolochene synthase into an (E)-beta-farnesene synthase. PubMed: Volatile sesquiterpene hydrocarbons characteristic for Penicillium roqueforti strains producing PR toxin. PubMed: Sex pheromone components in oral secretions and crop of male Caribbean fruit flies, Anastrepha suspensa (Loew). PubMed: [Chemical constituents of essential oil from roots and rhizomes of Valeriana alernifolia Bunge]. PubMed: Correspondence of soldier defense secretion mixtures with cuticular hydrocarbon phenotypes for chemotaxonomy of the termite genus Reticulitermes in North America. PubMed: Production of yarrow (Achillea millefolium L.) in Norway: essential oil content and quality. PubMed: The cyclization of farnesyl diphosphate and nerolidyl diphosphate by a purified recombinant delta-cadinene synthase. PubMed: The main citral-geraniol and carvacrol chemotypes of the essential oil of thymus pulegioides L. growing wild in vilnius district (Lithuania). PubMed: Production of volatile sesquiterpenes by Fusarium sambucinum strains with different abilities to synthesize trichothecenes. PubMed: Quantitative analysis of pheromone production in irradiated Caribbean fruit fly males,Anastrepha suspensa (Loew). PubMed: [Stomachic principles in ginger. II. Pungent and anti-ulcer effects of low polar constituents isolated from ginger, the dried rhizoma of Zingiber officinale Roscoe cultivated in Taiwan. The absolute stereostructure of a new diarylheptanoid]. PubMed: Comparison of volatiles emitted by male caribbean and mexican fruit flies. PubMed: The essential oil from Thymus praecox ssp. arcticus growing in Iceland. PubMed: Identification of the defensive secretion from soldiers of the North American termite,Amitermes wheeleri (Desneux) (Isoptera: Termitidae).