3-butylidene phthalide
3-butylidenephthalide
Identification
| Name | 3-butylidene phthalide |
| CAS Number | 551-08-6 |
| EINECS | 208-991-3 |
| FDA UNII | S9178G4B3F |
| Molecular Formula | C12 H12 O2 |
| Molecular Weight | 188.22604000 |
| MDL Number | MFCD00047319 |
| CoE Number | 10083 |
Regulatory
| JECFA Food Flavoring | 1170 3-butylidenephthalide |
| DG SANTE Food Flavourings | 10.024 3-butylidenephthalide |
| FEMA Number | 3333 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 551-08-6 ; 3-BUTYLIDENEPHTHALIDE |
Physical Properties
| Appearance | yellow clear oily liquid (est) |
| Assay | 99.00 to 100.00 sum of isomers |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 1.10300 @ 25.00 °C., 1.09800 to 1.10300 @ 25.00 °C. |
| Pounds per Gallon - est. | 9.136 to 9.178 |
| Boiling Point | 319.00 to 321.00 °C. @ 760.00 mm Hg, 139.00 to 142.00 °C. @ 5.00 mm Hg |
| Vapor Pressure | 0.001000 mmHg @ 25.00 °C. (est) |
| Flash Point | > 212.00 °F. TCC ( > 100.00 °C. ) |
| logP (o/w) | 3.388 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | medium , |
| Substantivity | 376 hour(s) at 100.00 % |
| Odor Description |
at 10.00 % in dipropylene glycol. Celery, green, vegetable, lovage-like with a herbal note
|
| Odor sample from | FRUTAROM USA INC, |
| Taste Description | at 15.00 ppm. |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Human Experience | 2 % solution: no irritation or sensitization. |
| Oral/Parenteral Toxicity | oral-rat LD50 1850 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 3-butylidene phthalide usage levels up to | 2.0000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 8.60 (μg/capita/day) |
| Maximised Survey-derived Daily Intakes (MSDI-USA) | 7.00 (μg/capita/day) |
| Structure Class | III |
| baked goods | - |
| beverages(nonalcoholic) | - |
| beverages(alcoholic) | - |
| breakfast cereal | - |
| cheese | - |
| chewing gum | - |
| condiments / relishes | - |
| confectionery froastings | - |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | - |
| fruit ices | - |
| gelatins / puddings | - |
| granulated sugar | - |
| gravies | - |
| hard candy | - |
| 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 | - |
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...
FRUTAROM USA INC,
Flavor & Specialty Ingredients
Your preferred partner for flavour and fragrance success.
Lluch Essence S.L.
A family company dedicated to sales and distribution
Flexibility, availability, price and quality.
O'Laughlin Industries Inc.
Manufacturer of chemicals and ingredients used in flavors, fragrances, food, beverages and cosmetics
Leading the Flavor and Fragrance Industry since 1980.
Penta International Corporation
Chemistry innovation
At Penta, our products and services help businesses do business better.
Sigma-Aldrich
Complete Supply Chain
The perfect blend of products and services that bring your creativity to life.
Synerzine, Inc.
Innovation. Customization. Aroma Ingredients.
Synerzine is a leading supplier of flavor and fragrance ingredients.
Tianjin Danjun International Trade Co., LTD.
Quality Products
We know the Chinese chemical market well.
R C Treatt and Co Ltd
Innovative ingredient solutions
World-leading innovative ingredient solutions provider for the flavour, fragrance and FMCG industries.