prenyl benzoate
3-methylbut-2-enyl benzoate
Identification
| Name | prenyl benzoate |
| IUPAC | 3-methylbut-2-enyl benzoate |
| CAS Number | 5205-11-8 |
| EINECS | 225-998-7 |
| FDA UNII | O577ZIE86G |
| Molecular Formula | C12 H14 O2 |
| Molecular Weight | 190.24198000 |
| MDL Number | MFCD00036570 |
| Nikkaji Number | J235.998G |
| Beilstein | 2046710 |
| XlogP3 | 3.20 (est) |
Regulatory
| JECFA Food Flavoring | 2063 prenyl benzoate |
| DG SANTE Food Flavourings | 09.693 prenyl benzoate |
| FEMA Number | 4203 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 5205-11-8 ; PRENYL BENZOATE |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 1.01600 to 1.02500 @ 25.00 °C., 1.02000 to 1.02800 @ 20.00 °C. |
| Pounds per Gallon - (est). | 8.454 to 8.529 |
| Pounds per Gallon - est. | 8.497 to 8.564 |
| Refractive Index | 1.51400 to 1.52100 @ 20.00 °C. |
| Boiling Point | 109.00 to 111.00 °C. @ 2.00 mm Hg, 280.00 to 281.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.004000 mmHg @ 25.00 °C. (est) |
| Flash Point | 210.00 °F. TCC ( 98.89 °C. ) |
| logP (o/w) | 3.818 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
| Stability | alcoholic lotion |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | 96 hour(s) at 100.00 % |
| Odor Description |
at 100.00 %. A sweet, balsamic odor with tea-like quality and natural connotations Balsamic, Chocolate, Floral, Fruity, Metallic/ Metal, Ozone/Ozonic, Tea, Tuberose
|
| Taste Description | balsamic |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | oral-rat LD50 4700 mg/kg |
| Dermal Toxicity | skin-rabbit LD50 > 5000 mg/kg |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | flavor and fragrance agents |
| RIFM Fragrance Material Safety Assessment | Search |
| Recommendation for prenyl benzoate usage levels up to | 15.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 0.012 (μg/capita/day) |
| Modified Theoretical Added Maximum Daily Intake (mTAMDI) | 4900 (μg/person/day) |
| Threshold of Concern | 1800 (μg/person/day) |
| Structure Class | I |
| baked goods | 10.00000 |
| beverages(nonalcoholic) | 0.30000 |
| beverages(alcoholic) | 1.50000 |
| breakfast cereal | 0.30000 |
| cheese | - |
| chewing gum | 15.00000 |
| condiments / relishes | - |
| confectionery froastings | 1.50000 |
| egg products | 1.50000 |
| fats / oils | 1.50000 |
| fish products | - |
| frozen dairy | 6.00000 |
| fruit ices | 3.00000 |
| gelatins / puddings | 3.00000 |
| granulated sugar | - |
| gravies | - |
| hard candy | 5.00000 |
| imitation dairy | - |
| instant coffee / tea | 0.60000 |
| jams / jellies | 3.00000 |
| meat products | - |
| milk products | 0.60000 |
| nut products | - |
| other grains | - |
| poultry | - |
| processed fruits | - |
| processed vegetables | - |
| reconstituted vegetables | - |
| seasonings / flavors | 1.50000 |
| snack foods | - |
| soft candy | 3.00000 |
| 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) | - |
| 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) | 20.00000 |
| 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) | - |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0) | 5.00000 |
Azelis UK Ltd.
Chemical Distribution
Azelis is a leading global distributor of speciality chemicals.
Berje Inc.
Where the world comes to its senses
Where the world comes to its senses - Berjé is a global distributor of Essential Oils and Aromatic Chemicals.
BOC Sciences
Best of Chemicals Supplier
Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecul...
Lluch Essence S.L.
A family company dedicated to sales and distribution
Flexibility, availability, price and quality.
M&U International LLC
Steady supply & demand
Meeting customers increasing demands at home as well as abroad.
Penta International Corporation
Chemistry innovation
At Penta, our products and services help businesses do business better.
Synerzine, Inc.
Innovation. Customization. Aroma Ingredients.
Synerzine is a leading supplier of flavor and fragrance ingredients.
Taytonn ASCC Pte Ltd
Supplying Asia Pacific
We fully understand the demands of the F&F industry and we endeavour to supply quality products, with ready availability and a personalised service.
The John D. Walsh Company, Inc
Suppliers Since 1942
Supplying the fragrance and flavor industry with high quality products.
Tianjin Danjun International Trade Co., LTD.
Quality Products
We know the Chinese chemical market well.
