Articles:
Notes:
None found
| Fragrance Demo Formulas | ||
| Name: | 2,6-dimethyloctan-2-ol | |
| CAS Number: | 18479-57-7 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 242-361-9 | |
| Nikkaji Web: | J222.212D | |
| MDL: | MFCD00128268 | |
| XlogP3-AA: | 3.30 (est) | |
| Molecular Weight: | 158.28454000 | |
| Formula: | C10 H22 O | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 97.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.82100 to 0.82900 @ 25.00 °C. |
| Pounds per Gallon - (est).: | 6.832 to 6.898 |
| Specific Gravity: | 0.82200 to 0.83000 @ 20.00 °C. |
| Pounds per Gallon - est.: | 6.848 to 6.914 |
| Refractive Index: | 1.43200 to 1.43700 @ 20.00 °C. |
| Boiling Point: | 197.00 to 201.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.115000 mmHg @ 25.00 °C. (est) |
| Vapor Density: | 5.5 ( Air = 1 ) |
| Flash Point: | 161.00 °F. TCC ( 71.67 °C. ) |
| logP (o/w): | 3.540 |
| Shelf Life: | 24.00 month(s) or longer if stored properly. |
| Storage: | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| Soluble in: | |
| alcohol | |
| water, 188.9 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| Stability: | |
| acid cleaner | |
| alcoholic lotion, good | |
| antiperspirant, good | |
| bleach, good | |
| deo stick | |
| detergent perborate, good | |
| fabric softener, good | |
| hard surface cleaner | |
| liquid detergent, good | |
| shampoo | |
| soap, good | |
Organoleptic Properties:
| Odor Type: | citrus |
| Odor Strength: | medium |
| Odor Description: at 100.00 %. | fresh sweet citrus lime floral lily |
| Substantivity: | 6 hour(s) at 100.00 % |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Safety Information:
| Most important hazard(s): | |
| Xi - Irritant | |
|
R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing. | |
| Oral/Parenteral Toxicity: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | fragrance agents | ||
| maximum skin levels for fine fragrances: | |||
| 0.7100 % and are based on the assumption that the fragrance mixture is used at 20% in a consumer product (IFRA Use Level Survey). (IFRA, 2004) | |||
| Recommendation for tetrahydromyrcenol usage levels up to: | |||
| 30.0000 % in the fragrance concentrate. | |||
| use level in formulae for use in cosmetics: | |||
| 2.5000 % | |||
| Dermal Systemic Exposure in Cosmetic Products: | |||
| 0.064 mg/kg/day (IFRA, 2004) | |||
| Recommendation for tetrahydromyrcenol flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| EPA Substance Registry Services (TSCA): | 18479-57-7 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 86751 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WISER: | UN 1993 |
| WGK Germany: | 2 |
| 2,6-dimethyloctan-2-ol | |
| Chemidplus: | 0018479577 |
References:
| 2,6-dimethyloctan-2-ol | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 18479-57-7 |
| Pubchem (cid): | 86751 |
| Pubchem (sid): | 135042305 |
| Pherobase: | View |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2009 |
| (IUPAC): | Atomic Weights of the Elements 2009 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2905.19.0000 |
| ChemSpider: | View |
Potential Blenders and core components note
Potential Uses:
| agrumen aldehyde | FR | |
| aldehydic | FR | |
| amber | FR | |
| crabapple | FR | |
| apple green apple | FR | |
| bark | FR | |
| bergamot | FR | |
| blossom tropical blossom | ||
| bubble gum | FR | |
| calamus oil replacer | FR | |
| citronella | FR | |
| citrus | FR | |
| cloudberry bakeapple | FL | |
| colonia | FR | |
| curacao | FR | |
| cypress oil replacer | FR | |
| elder flower | FR | |
| fern | FR | |
| fir balsam | FR | |
| floral | FR | |
| florida breeze | FR | |
| forest | FR | |
| grape | FR | |
| guava | FR | |
| herbal | FR | |
| hibiscus | FR | |
| kewda | FR | |
| kumquat | FR | |
| lavender | FR | |
| lemon | FR | |
| lily | FR | |
| lily of the valley | FR | |
| lime | FR | |
| linden flower | FR | |
| mint | FR | |
| mock orange | FR | |
| pansy | FR | |
| pear | FR | |
| petitgrain | FR | |
| petitgrain bergamot petitgrain | FL/FR | |
| pine | FR | |
| pineapple | FR | |
| rain | FR | |
| rhubarb | FR | |
| starfruit | FL | |
| sweet grass | FR | |
| sweet pea | FR | |
| wet fields | ||
| wintergreen | FR | |
| woody | FR |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| 2,6- | dimethyl octan-2-ol |
| 2,6- | dimethyl-2-octanol |
| 2,6- | dimethyloctan-2-ol |
| octan-2-ol, 2,6-dimethyl- | |
| 2- | octanol, 2,6-dimethyl- |
| tetra hydro myrcenol | |
| tetrahydro myrcenol |