| CAS Number: | 29957-43-5 | 3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 249-975-6 |
| FDA UNII: | 178N3EI4PV |
| Nikkaji Web: | J249.896K |
| CoE Number: | 10202 |
| XlogP3-AA: | 2.80 (est) |
| Molecular Weight: | 152.23672000 |
| Formula: | C10 H16 O |
| NMR Predictor: | Predict (works with chrome or firefox) |
| EFSA/JECFA Comments: | CASrn in Register to be changed to 53834-70-1, which covers (E)-3,7-Dimethylocta-1,5,7-trien-3-ol. Register name to be changed to (E)-3,7-Dimethylocta-1,5,7-trien-3-
ol. (R)- or (S)-enantiomer not specified by CASrn 53834-70-1. |
Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 93.00 to 100.00 %
|
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.87800 to 0.88600 @ 25.00 °C.
|
| Pounds per Gallon - (est).: | 7.306 to 7.372
|
| Refractive Index: | 1.48900 to 1.49500 @ 20.00 °C.
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| Boiling Point: | 62.00 °C. @ 4.50 mm Hg
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| Boiling Point: | 228.00 to 229.00 °C. @ 760.00 mm Hg (est)
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| Acid Value: | 1.00 max. KOH/g
|
| Vapor Pressure: | 0.014000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 192.00 °F. TCC ( 89.00 °C. ) (est)
|
| logP (o/w): | 2.408 (est) |
| Soluble in: |
| | alcohol | | | water, 406.5 mg/L @ 25 °C (est) |
| Insoluble in: |
| | water |
Organoleptic Properties:
| Odor Strength: | medium |
| |
Odor Description: at 100.00 %. | mouldy |
| |
| Odor and/or flavor descriptions from others (if found). |
| |
| |
Cosmetic Information:
Suppliers:
Safety Information:
| |
| Hazards identification |
| |
| Classification of the substance or mixture |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
| None found. |
| GHS Label elements, including precautionary statements |
| |
| Pictogram | |
| |
| Hazard statement(s) |
| None found. |
| Precautionary statement(s) |
| None found. |
| Oral/Parenteral Toxicity: |
|
Not determined
|
| Dermal Toxicity: |
|
Not determined
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| Inhalation Toxicity: |
|
Not determined
|
Safety in Use Information:
| Category: | flavor and fragrance agents |
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice |
| Recommendation for dehydrolinalool usage levels up to: | | | 2.0000 % in the fragrance concentrate.
|
| |
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 12.00 (μg/capita/day) |
| Threshold of Concern: | 540 (μg/person/day) |
| Structure Class: | II |
| 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: 18 |
| Click here to view publication 18 |
| | average usual ppm | average maximum ppm |
| baked goods: | - | - |
| beverages(nonalcoholic): | 0.05000 | 0.50000 |
| beverages(alcoholic): | 0.20000 | 2.00000 |
| breakfast cereal: | - | - |
| cheese: | - | - |
| chewing gum: | 5.00000 | 50.00000 |
| condiments / relishes: | - | - |
| confectionery froastings: | 0.20000 | 2.00000 |
| egg products: | - | - |
| fats / oils: | - | - |
| fish products: | - | - |
| frozen dairy: | 0.20000 | 2.00000 |
| fruit ices: | 0.20000 | 2.00000 |
| gelatins / puddings: | 0.50000 | 5.00000 |
| granulated sugar: | - | - |
| gravies: | - | - |
| hard candy: | 0.50000 | 5.00000 |
| imitation dairy: | - | - |
| instant coffee / tea: | 0.20000 | 2.00000 |
| jams / jellies: | - | - |
| meat products: | - | - |
| milk products: | 0.20000 | 2.00000 |
| nut products: | - | - |
| other grains: | - | - |
| poultry: | - | - |
| processed fruits: | 0.10000 | 1.00000 |
| processed vegetables: | - | - |
| reconstituted vegetables: | - | - |
| seasonings / flavors: | - | - |
| snack foods: | - | - |
| soft candy: | 0.50000 | 5.00000 |
| soups: | - | - |
| sugar substitutes: | - | - |
| sweet sauces: | - | - |
Safety References:
| European Food Safety Athority(EFSA): | Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies... |
| European Food Safety Authority (EFSA) reference(s): |
Scientific Opinion on Flavouring Group Evaluation 18, Revision 2 (FGE.18Rev2): Aliphatic, alicyclic and aromatic saturated and unsaturated tertiary alcohols, aromatic tertiary alcohols and their esters from chemical groups 6 and 8. View page or View pdf |
Statement on the Re-evaluation of 3,7-dimethylocta-1,5,7-trien-3-ol [FL-no: 02.146] based on additional data on a supporting substance View page or View pdf |
Scientific Opinion on Flavouring Group Evaluation 18, Revision 3 (FGE.18Rev3): Aliphatic, alicyclic and aromatic saturated and unsaturated tertiary alcohols, aromatic tertiary alcohols and their esters from chemical groups 6 and 8. View page or View pdf |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 5366264 |
| National Institute of Allergy and Infectious Diseases: | Data |
| | 3,7-dimethylocta-1,5,7-trien-3-ol |
| Chemidplus: | 0029957435 |
References:
Other Information:
Potential Blenders and core components note
Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
| 3,7- | dimethyl octa-1,5,7-trien-3-ol | | 3,7- | dimethyl-1,5,7-octatrien-3-ol | | 3,7- | dimethylocta-1,5,7-trien-3-ol | | 1,5,7- | octatrien-3-ol, 3,7-dimethyl- |
Articles:
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