grapefruit menthane
(+/-)-2,8-epithio-cis-p-menthane
Identification
| Name | grapefruit menthane |
| IUPAC | 4,7,7-trimethyl-6-thiabicyclo[3.2.1]octane |
| CAS Number | 68398-18-5 |
| EINECS | 269-970-2 |
| FDA UNII | EMJ1A8616F |
| Molecular Formula | C10 H18 S |
| Molecular Weight | 170.31846000 |
| MDL Number | MFCD00678284 |
| Nikkaji Number | J349.388A |
Regulatory
| JECFA Food Flavoring | 1685 (+/-)-2,8-epithio-cis-p-menthane |
| DG SANTE Food Flavourings | 12.120 2,8-epithio-p-menthane |
| FEMA Number | 4108 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | 68398-18-5 ; (+/-)-2,8-EPITHIO-CIS-P-MENTHANE |
Physical Properties
| Appearance | colorless to amber clear liquid (est) |
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.99900 to 1.00500 @ 25.00 °C. |
| Pounds per Gallon - (est). | 8.313 to 8.363 |
| Refractive Index | 1.51100 to 1.51700 @ 20.00 °C. |
| Boiling Point | 222.00 to 223.00 °C. @ 760.00 mm Hg |
| Acid Value | 1.00 max. KOH/g |
| Vapor Pressure | 0.149000 mmHg @ 25.00 °C. (est) |
| Flash Point | 192.00 °F. TCC ( 88.89 °C. ) |
| logP (o/w) | 4.187 (est) |
| Soluble in | alcohol |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | perfuming agents |
Organoleptic Properties
| Odor Strength | high , |
| Substantivity | 53 hour(s) at 100.00 % |
| Odor Description |
at 1.00 % in dipropylene glycol. at 1.00 %. Strong penetrating grapefruit-like
|
| Odor sample from | Kingchem Laboratories Inc. |
| Taste Description |
sulfurous juicy green fruity tropical passion fruit mango spruce at 1.00 ppm. Grapefruit-like
|
Safety Information
| European information | Most important hazard(s): |
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| 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 grapefruit menthane usage levels up to | 0.8000 % in the fragrance concentrate. |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 3.70 (μg/capita/day) |
| Modified Theoretical Added Maximum Daily Intake (mTAMDI) | 370 (μg/person/day) |
| NOEL (No Observed Effect Level) | 10 (mg/kg bw per day) |
| Threshold of Concern | 90 (μg/person/day) |
| Structure Class | III |
| baked goods | - |
| beverages(nonalcoholic) | 0.05000 |
| beverages(alcoholic) | 0.05000 |
| breakfast cereal | - |
| cheese | - |
| chewing gum | 0.08000 |
| condiments / relishes | 0.01000 |
| confectionery froastings | 0.02000 |
| egg products | - |
| fats / oils | - |
| fish products | - |
| frozen dairy | 0.02000 |
| fruit ices | 0.05000 |
| gelatins / puddings | 0.02000 |
| granulated sugar | - |
| gravies | 0.00500 |
| hard candy | 0.08000 |
| imitation dairy | - |
| instant coffee / tea | - |
| jams / jellies | 0.02000 |
| meat products | 0.02000 |
| milk products | - |
| nut products | - |
| other grains | - |
| poultry | - |
| processed fruits | 0.02000 |
| processed vegetables | 0.01000 |
| reconstituted vegetables | 0.01000 |
| seasonings / flavors | 0.01000 |
| snack foods | 0.03000 |
| soft candy | 0.05000 |
| soups | 0.03000 |
| sugar substitutes | - |
| sweet sauces | - |
| Dairy products, excluding products of category 02.0 (01.0) | 2.00000 |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0) | 0.20000 |
| Edible ices, including sherbet and sorbet (03.0) | 0.40000 |
| Processed fruit (04.1) | 0.30000 |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2) | - |
| Confectionery (05.0) | 0.40000 |
| Chewing gum (05.3) | - |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0) | 0.20000 |
| Bakery wares (07.0) | 0.40000 |
| Meat and meat products, including poultry and game (08.0) | 0.10000 |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0) | 0.10000 |
| Eggs and egg products (10.0) | - |
| Sweeteners, including honey (11.0) | - |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0) | 0.20000 |
| Foodstuffs intended for particular nutritional uses (13.0) | 0.40000 |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1) | 0.20000 |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2) | 0.50000 |
| Ready-to-eat savouries (15.0) | 1.00000 |
| Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0) | 0.20000 |
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