laevo-citronellol
(-)-3,7-dimethyl-6-octen-1-ol
Identification
| Name | laevo-citronellol |
| IUPAC | (3S)-3,7-dimethyloct-6-en-1-ol |
| CAS Number | 7540-51-4 |
| EINECS | 231-415-7 |
| FDA UNII | 8RSY5Y5658 |
| Molecular Formula | C10 H20 O |
| Molecular Weight | 156.26860000 |
| MDL Number | MFCD00063214 |
| Nikkaji Number | J67.958E |
| Beilstein | 1721505 |
| CoE Number | 59 |
Regulatory
| DG SANTE Food Flavourings | 02.229 (-)-3,7-dimethyl-6-octen-1-ol |
| FEMA Number | 2309 |
| FDA | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm (SATF) | LAEVO-CITRONELLOL |
| FDA Regulation | FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION |
Physical Properties
| Appearance | colorless clear liquid (est) |
| Assay | 98.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Specific Gravity | 0.84800 to 0.85800 @ 25.00 °C. |
| Pounds per Gallon - (est). | 7.056 to 7.139 |
| Refractive Index | 1.44900 to 1.45900 @ 20.00 °C. |
| Optical Rotation | -5.50 to -3.50 |
| Boiling Point | 225.00 °C. @ 760.00 mm Hg, 108.00 to 110.00 °C. @ 10.00 mm Hg |
| Vapor Pressure | 0.018000 mmHg @ 25.00 °C. (est) |
| Flash Point | 216.00 °F. TCC ( 102.22 °C. ) |
| logP (o/w) | 3.239 (est) |
| Soluble in | alcohol |
| Insoluble in | water |
| Stability | detergent |
Cosmetic Information
| CosIng | cosmetic data |
| Cosmetic Uses | fragrance |
Organoleptic Properties
| Odor Strength | medium |
| Substantivity | 56 hour(s) at 100.00 % |
| Odor Description |
at 100.00 %. Fresh, sweet-rosy Floral-rose and geranium, powdery, waxy, clean
|
| Odor sample from | Takasago International Corp |
| Taste Description | floral rose green waxy citrus |
Safety Information
| Preferred SDS | View |
| European information | Most important hazard(s): |
| Human Experience | 6% no sensitization. |
| Oral/Parenteral Toxicity | oral-rat LD50 3450 mg/kg |
| Dermal Toxicity | skin-rabbit LD50 2650 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 |
| IFRA Critical Effect | Dermal sensitization |
| IFRA RESTRICTION LIMITS IN THE FINISHED PRODUCT (%) | Category 1: Products applied to the lips |
| Notes | IFRA FLAVOR REQUIREMENTS: |
| Maximised Survey-derived Daily Intakes (MSDI-EU) | 69.00 (μg/capita/day) |
| Modified Theoretical Added Maximum Daily Intake (mTAMDI) | 1400 (μg/person/day) |
| Threshold of Concern | 1800 (μg/person/day) |
| Structure Class | I |
| baked goods | - |
| beverages(nonalcoholic) | - |
| beverages(alcoholic) | - |
| breakfast cereal | - |
| cheese | - |
| chewing gum | 29.00000 |
| 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 | - |
| Dairy products, excluding products of category 02.0 (01.0) | 1.03000 |
| Fats and oils, and fat emulsions (type water-in-oil) (02.0) | - |
| Edible ices, including sherbet and sorbet (03.0) | - |
| Processed fruit (04.1) | - |
| Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2) | - |
| Confectionery (05.0) | 4.46000 |
| Chewing gum (05.3) | - |
| Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0) | - |
| Bakery wares (07.0) | 6.47000 |
| Meat and meat products, including poultry and game (08.0) | - |
| Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0) | - |
| Eggs and egg products (10.0) | - |
| Sweeteners, including honey (11.0) | - |
| Salts, spices, soups, sauces, salads, protein products, etc. (12.0) | - |
| Foodstuffs intended for particular nutritional uses (13.0) | - |
| Non-alcoholic ("soft") beverages, excl. dairy products (14.1) | 1.30000 |
| Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2) | 1.03000 |
| 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) | - |
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