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saffron indenone
General Material Information
| Preferred name | saffron indenone |
| Trivial Name | 2,3-Dihydro-2,3,3-trimethyl-1H-inden-1-one |
| Short Description | safraleine (Givaudan) |
| Formula | C12 H14 O |
| CAS Number | 54440-17-4 |
| FEMA Number | 4556 |
| FDA UNII | 19D876M98B |
| xLogP3-AA | 3.10 (est) |
| NMR Predictor | External link |
| JECFA Food Flavoring | 2047 2,3,3-trimethylindan-1-one |
| FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm | 54440-17-4 ; 2,3,3-TRIMETHYLINDANONE |
| Synonyms |
|
US / EU / FDA / JECFA / FEMA / Scholar / Patents
| 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 |
Literature & References
| 2,3,3-trimethyl-2H-inden-1-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 10149036 |
| Pubchem (sid): | 135264308 |
| Publications by Info | |
| Safraleine | |
| Publications by US Patents | |
| 7,538,243 - Indanes and indanones and their use in perfumery | |
Other Information
| (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 |
| HMDB (The Human Metabolome Database): | Search |
| ChemSpider: | View |
| FAO: | 2,3,3-Trimethylindan-1-one |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 174.24278259277 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 8.446 to 8.529 |
| Refractive Index | 1.532 to 1.542 @ 20 °C |
| Boiling Point | 250 to 252°C @ 760 mm Hg |
| Vapor Pressure | 0.013 mmHg @ 25 °C |
| Flash Point TCC Value | 120 °C TCC |
| logP (o/w) | 3.516 est |
| Solubility | |
| alcohol | Yes |
| water, 73.7 mg/L @ 25 °C (est) | Yes |
| water | No |
| Stability | |
| alcoholic - good | Unspecified |
| antiperspirant spray - poor | Unspecified |
| APC (pH = 10) - good | Unspecified |
| candles - good | Unspecified |
| damp fabric - good | Unspecified |
| dry fabric - good | Unspecified |
| liquid bleach - poor | Unspecified |
| pH = 2 - moderate | Unspecified |
| powder detergent - good | Unspecified |
| powder detergent + activator - good | Unspecified |
| soap - good | Unspecified |
| toiletries - good | Unspecified |
Organoleptic Properties
| Odor Type: Herbal | |
| herbal, leathery, saffron, marine, phenolic, tobacco, woody | |
| Odor strength | high , recommend smelling in a 10.00 % solution or less |
| Substantivity | 168 hour(s) at 10.00 % in dipropylene glycol |
| Luebke, William tgsc, (2007) | At 10.00 % in dipropylene glycol. herbal leather saffron iodine phenolic tobacco woody |
| Flavor Type: Herbal | |
| herbal, dry, saffron, tobacco, sage, spicy, phenolic, leathery | |
| Luebke, William tgsc, (2007) | Herbal dry saffron tobacco sage spicy phenolic leathery |
Potential Uses
| Applications | |
| Odor purposes | Acacia, Agate, Allspice, Amber, Ambergris, Angelica, Animal, Beeswax absolute replacer, Calamus oil replacer, Cassia, Cassia blossom, Cedar, Cedar forest, Champaca, Chestnut blossom, Chrysanthemum, Chypre, Cigar, Cistus, Clove, Clove blossom, Coronilla, Croton eluteria bark, Dahlia, Deertongue absolute replacer, Dogwood, Fern, Fig, Fir balsam, Fir needle oil replacer, Floral, Flouve, Flouve blossom, Forest, Galangal root, Ginger, Ginger white ginger, Guaiacwood, Gurjun balsam, Hay new mown hay, Herbal, Incense, Iris blossom, Ivy, Jonquil, Juniper, Leather, Lovage root, Musk, Ocean sea, Oriental, Osmanthus, Patchouli, Petunia, Pinion, Redwood, Rose d'orient, Saffron, Sandalwood, Sap, Savin, Soapy sandalwood moss, Spice, Spicewood, Sweet grass, Tobacco, Vanilla, Woodruff, Woody |
| Flavoring purposes | Angelica, Cistus, Croton eluteria bark, Galangal root, Guaiacwood, Lovage root, Savin |
| Other purposes | Clean, Diffusion, Dry, Fantasy blends |
Safety Information
Safety information
| Hazards identification | |
| Classification of the substance or mixture | |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) | |
| Acute toxicity, Oral (Category 5), H303 Acute toxicity, dermal (Category 5), H313 Skin irritation (Category 2), H315 Acute aquatic toxicity (Category 3), H402 Chronic aquatic toxicity (Category 3), H412 | |
| GHS Label elements, including precautionary statements | |
| Pictogram |   |
| Signal word | Danger |
| Hazard statement(s) | |
| H303 - May be harmfulif swallowed H313 - May be harmful in contact with skin H315 - Causes skin irritation H402 - Harmful to aquatic life H412 - Harmful to aquatic life with long lasting effects | |
| Precautionary statement(s) | |
| P264 - Wash skin thouroughly after handling. P273 - Avoid release to the environment. P280 - Wear protective gloves/protective clothing/eye protection/face protection. P302 + P352 - IF ON SKIN: wash with plenty of soap and water. P312 - Call a POISON CENTER or doctor/physician if you feel unwell. P332 + P313 - IF SKIN irritation occurs: Get medical advice/attention. P362 - Take off contaminated clothing and wash before reuse. P501 - Dispose of contents/ container to an approved waste disposal plant. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in use information
| 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 saffron indenone usage levels up to: | |||
| 3.0000 % in the fragrance concentrate. | |||
| 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: 24 | |||
| Click here to view publication 24 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | 0.00500 | 0.03000 | |
| beverages(nonalcoholic): | 0.01000 | 0.03000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | 0.00500 | 0.02000 | |
| condiments / relishes: | 0.01000 | 0.01000 | |
| confectionery froastings: | 0.03000 | 0.05000 | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | 0.00500 | 0.02000 | |
| fruit ices: | 0.01000 | 0.02000 | |
| gelatins / puddings: | - | - | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | 0.00500 | 0.01000 | |
| imitation dairy: | - | - | |
| instant coffee / tea: | - | - | |
| jams / jellies: | 0.03000 | 0.05000 | |
| meat products: | 0.30000 | 5.00000 | |
| milk products: | - | - | |
| nut products: | - | - | |
| other grains: | - | - | |
| poultry: | - | - | |
| processed fruits: | - | - | |
| processed vegetables: | - | - | |
| reconstituted vegetables: | - | - | |
| seasonings / flavors: | - | - | |
| snack foods: | - | - | |
| soft candy: | - | - | |
| soups: | 0.00500 | 0.02000 | |
| sugar substitutes: | - | - | |
| sweet sauces: | 0.03000 | 0.05000 | |
Safety references
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):54440-17-4 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :10149036 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| 2,3,3-trimethyl-2H-inden-1-one |
| Chemidplus:0054440174 |