beta-santalol

12-beta-santalen-14-ol

CAS: 77-42-9 C15 H24 O MW: 220.35548000

Identification

Namebeta-santalol
IUPAC(Z)-2-methyl-5-(6-methyl-5-methylidene-6-bicyclo[2.2.1]heptanyl)pent-2-en-1-ol
CAS Number77-42-9
EINECS201-027-2
FDA UNII1JL7K2LW6L
Molecular FormulaC15 H24 O
Molecular Weight220.35548000
Nikkaji NumberJ2.946.646G
CoE Number74

Regulatory

DG SANTE Food Flavourings02.216 12-beta-santalen-14-ol
FEMA Number3006
FDANo longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF)77-42-9 ; SANTALOL, BETA
FDA RegulationFDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION

Physical Properties

Assay 95.00 to 100.00
Food Chemicals Codex Listed No
Specific Gravity 0.96500 to 0.97500 @ 25.00 °C.
Pounds per Gallon - (est). 8.030 to 8.113
Refractive Index 1.49800 to 1.50900 @ 20.00 °C.
Boiling Point 311.00 to 313.00 °C. @ 760.00 mm Hg
Vapor Pressure 0.000048 mmHg @ 25.00 °C. (est)
Flash Point 241.00 °F. TCC ( 116.11 °C. )
logP (o/w) 4.446 (est)
Soluble in alcohol
Insoluble in water

Cosmetic Information

CosIngcosmetic data
Cosmetic Usesperfuming agents

Organoleptic Properties

Odor Description at 100.00 %.

Safety Information

European informationMost important hazard(s):
Oral/Parenteral ToxicityNot determined
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-santalol usage levels up to3.0000 % in the fragrance concentrate.
Maximised Survey-derived Daily Intakes (MSDI-EU)0.085 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI)3900 (μg/person/day)
Threshold of Concern1800 (μg/person/day)
Structure ClassI
baked goods1.00000
beverages(nonalcoholic)0.06000
beverages(alcoholic)-
breakfast cereal-
cheese-
chewing gum-
condiments / relishes-
confectionery froastings-
egg products-
fats / oils-
fish products-
frozen dairy0.35000
fruit ices0.35000
gelatins / puddings-
granulated sugar-
gravies-
hard candy1.00000
imitation dairy-
instant coffee / tea-
jams / jellies-
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-
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)2.00000
Sweeteners, including honey (11.0)2.00000
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

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Potential Uses

FR acacia FR amber FR ambergris FR ambreine FR amyris FL/FR angelica FR ash mountain ash FR bark FR bayberry FL/FR beech FL/FR benzoin absolute replacer FR bergamot FL/FR birch tar FR bois de rose FR boronia FR boxwood FL buchu leaf FR cabreuva wood FR cade oil replacer FR calamus oil replacer FR cardamom oil replacer FR cedar FR cedar forest FR cedarwood FR cedarwood atlas FR celery FR cigar FL/FR cistus FR citronella FR clary sage oil replacer FR costus FL/FR croton eluteria bark FR cypress oil replacer FR dogwood FR elemi FR fern FR fir needle oil replacer FR forest FR frankincense FL/FR galangal root FR galbanum FR ginger FR gingergrass FL/FR guaiacwood FR gurjun balsam FR hay new mown hay FR heather FR hinoki oil replacer FL/FR hyssop FR iris blossom FR juniper FR juniper berry FR labdanum FR mace FR maja FR mimosa FR oakwood FR opoponax FL/FR orange bitter orange peel FR oregano FR orris FR osmanthus FR patchouli FR pine forest FL/FR pine needle FL/FR pine scotch pine FR pinion FR redwood FR sandalwood FR spikenard oil replacer FR spruce FR sweet grass FL/FR tansy oil replacer FL/FR tarragon oil replacer FL tea black tea timber FR tolu balsam FL/FR valerian FR vetiver FR woody FR wormseed oil replacer

Natural Occurrence

ginger rhizome oil osmanthus absolute @ 0.02% Data sandalwood oil

Synonyms

(1S-(1alpha,2alpha(Z),4alpha))-2- methyl-5-(2-methyl-3-methylene bicyclo(2.2.1)hept-2-yl)-2-penten-1-ol 2- methyl-5-(2-methyl-3-methylene-2-norbornyl)-2-penten-1-ol (1S-(1a,2a(Z),4a))-2- methyl-5-(2-methyl-3-methylenebicyclo(2.2.1)hept-2-yl)-2-penten-1-ol 2- methyl-5-(2-methyl-3-methylenebicyclo(2.2.1)hept-2-yl)-2-penten-1-ol, (1S-(1a,2a(Z(,4a))- (2Z)-2- methyl-5-(2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl)-2-penten-1-ol (Z)-2- methyl-5-(6-methyl-5-methylidene-6-bicyclo[2.2.1]heptanyl)pent-2-en-1-ol 2- penten-1-ol, 2-methyl-5-(2-methyl-3-methylenebicyclo(2.2.1)hept-2-yl)-, (1S-(1a,2a(Z),4a))- 12-beta- santalen-14-ol beta- santalenol (Z)-b- santalol PubMed: Structure-odor relationships of semisynthetic β-santalol analogs. PubMed: endo/exo stereoselectivity in Diels-Alder reactions of α,β-dialkylated conjugated enals to cyclic 1,3-dienes: intermediates in the synthesis of (-)-β-santalol and its analogs. PubMed: Suppression of lipopolysaccharide-stimulated cytokine/chemokine production in skin cells by sandalwood oils and purified α-santalol and β-santalol. PubMed: A rare type of sesquiterpene and β-santalol derivatives from Santalum album and their cytotoxic activities. PubMed: The transcriptome of sesquiterpenoid biosynthesis in heartwood xylem of Western Australian sandalwood (Santalum spicatum). PubMed: In vitro anti-viral effect of β-santalol against influenza viral replication. PubMed: The synthesis of (Z)-trisubstituted allylic alcohols by the selective 1,4-hydrogenation of dienol esters: improved synthesis of (-)-β-santalol. PubMed: Acaricidal and oviposition deterring effects of santalol identified in sandalwood oil against two-spotted spider mite, Tetranychus urticae Koch (Acari: Tetranychidae). PubMed: Chemopreventive effects of alpha-santalol on ultraviolet B radiation-induced skin tumor development in SKH-1 hairless mice. PubMed: Anticancer Effects of Sandalwood (Santalum album). PubMed: Structure-activity relationships of sandalwood odorants: total synthesis and fragrance properties of cyclopropano-beta-santalol. PubMed: Syntheses and odor of "bulky group"-modified sandalwood odorants: isophorono-beta-santalol analogues. PubMed: Structure-activity relationships of sandalwood odorants: synthesis and odor of tricyclo beta-santalol. PubMed: Structure-activity relationships of sandalwood odorants: synthesis and odour of methyl-beta-santalol. PubMed: Synthesis and olfactoric activity of side-chain modified beta-santalol analogues. PubMed: Repellent effect of santalol from sandalwood oil against Tetranychus urticae (Acari: Tetranychidae). PubMed: Geographic and phenotypic variation in heartwood and essential-oil characters in natural populations of Santalum austrocaledonicum in Vanuatu. PubMed: α- and β-Santalols Directly Interact with Tubulin and Cause Mitotic Arrest and Cytotoxicity in Oral Cancer Cells. PubMed: Enantioselective synthesis of (-)-beta-santalol by a copper-catalyzed enynol cyclization-fragmentation reaction. PubMed: Hawaiian sandalwood: oil composition of Santalum paniculatum and comparison with other sandal species. PubMed: Effect of α-santalol and β-santalol from sandalwood on the central nervous system in mice. PubMed: Biosynthesis of Sandalwood Oil: Santalum album CYP76F cytochromes P450 produce santalols and bergamotol. PubMed: Preparative separation of α- and β-santalenes and (Z)-α- and (Z)-β-santalols using silver nitrate-impregnated silica gel medium pressure liquid chromatography and analysis of sandalwood oil. PubMed: Chemical composition of volatile oils from the pericarps of Indian sandalwood (Santalum album) by different extraction methods. PubMed: Chemical composition of the essential oils of Clausena lansium from Hainan Island, China. PubMed: Structure-activity relationships of sandalwood odorants: synthesis of a new campholene derivative. PubMed: Synthesis of new exo- and endo-3,8-dihydro-beta-santalols and other norbornyl-derived alcohols. PubMed: Anti-Helicobacter pylori compounds from Santalum album. PubMed: Comprehensive two-dimensional gas chromatography with flame ionization and time-of-flight mass spectrometry detection: qualitative and quantitative analysis of West Australian sandalwood oil. PubMed: Comparative molecular and phytochemical study of the tree species Santalum austrocaledonicum (Santalaceae) distributed in the New-Caledonian archipelago. PubMed: Composition, antimicrobial activity and cytotoxicity of essential oils from Aristolochia mollissima. PubMed: Evaluation of the quality of sandalwood essential oils by gas chromatography-mass spectrometry. PubMed: Analysis of fragrance compounds in blood samples of mice by gas chromatography, mass spectrometry, GC/FTIR and GC/AES after inhalation of sandalwood oil.