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styralyl alcohol
General Material Information
| Preferred name | styralyl alcohol |
| Trivial Name | 1-Phenylethanol |
| Short Description | alpha-methylbenzyl alcohol |
| Formula | C8 H10 O |
| CAS Number | 98-85-1 |
| FEMA Number | 2685 |
| Flavis Number | 2.064 |
| ECHA Number | 202-707-1 |
| FDA UNII | E6O895DQ52 |
| Nikkaji Number | J3.224G |
| Beilstein Number | 1905149 |
| MDL | MFCD00004508 |
| COE Number | 2030 |
| xLogP3-AA | 1.40 (est) |
| Bio Activity Summary | External link |
| NMR Predictor | External link |
| JECFA Food Flavoring | 799 alpha-methylbenzyl alcohol |
| FDA Patent | No longer provide for the use of these seven synthetic flavoring substances |
| FDA Mainterm | 98-85-1 ; ALPHA-METHYLBENZYL ALCOHOL |
| 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
| Leffingwell: | Chirality or Article |
| 1-phenylethanol | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 98-85-1 |
| Pubchem (cid): | 7409 |
| Pubchem (sid): | 134971464 |
| Pherobase: | View |
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 |
| CHEBI: | View |
| CHEMBL: | View |
| UM BBD: | Search |
| KEGG (GenomeNet): | C07112 |
| HMDB (The Human Metabolome Database): | HMDB32619 |
| FooDB: | FDB010562 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
| Formulations/Preparations: grade: fcc | |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | Yes |
| Molecular weight | 122.16690063477 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 8.396 to 8.437 |
| Refractive Index | 1.525 to 1.529 @ 20 °C |
| Melting Point | 19 to 20°C @ 760 mm Hg |
| Boiling Point | 204 to 205°C @ 745 mm Hg |
| Vapor Pressure | 0.139 mmHg @ 25 °C |
| Vapor Density | 4.21 |
| Flash Point TCC Value | 85 °C TCC |
| logP (o/w) | 1.409 est |
| Solubility | |
| fixed oils | Yes |
| glycerin | Yes |
| water, 1.954e+004 mg/L @ 25 °C (est) | Yes |
| water, 1950 mg/L @ 25 °C (exp) | Yes |
| water | No |
| Stability | |
| bath salts | Unspecified |
| cream | Unspecified |
| hair spray | Unspecified |
| lotion | Unspecified |
| non-discoloring in most media | Unspecified |
| powder | Unspecified |
| shampoo | Unspecified |
Organoleptic Properties
| Odor Type: Chemical | |
| fresh, sweet, almond, gardenia, hyacinth, chemical, naphthyl, medicinal, camphoreous | |
| Odor strength | medium |
| Substantivity | 8 hour(s) at 100.00 % |
| Luebke, William tgsc, (1981) | At 100.00 %. fresh sweet acetophenone gardenia hyacinth |
| Mosciano, Gerard P&F 17, No. 4, 33, (1992) | Chemical, naphthyl, medicinal, sweet, with a camphoraceous nuance |
| Flavor Type: Chemical | |
| chemical, medicinal, balsamic, vanilla, woody | |
| Mosciano, Gerard P&F 17, No. 4, 33, (1992) | At 50.00 ppm. Chemical, medicinal, with a balsamic vanilla woody nuance |
Occurrences
| (data available) |
Potential Uses
| Applications | |
| Odor purposes | Apricot , Castoreum , Cherry , Floral , Gardenia , Grape , Hawthorn , Honey , Honeysuckle , Hyacinth , Lilac , Lily , Mimosa , Narcissus , Peach , Vanilla |
| Cosmetic purposes | Perfuming agents |
Safety Information
Safety information
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xn - Harmful. | |
| R 22 - Harmful if swallowed. R 38 - Irritating to skin. R 41 - Risk of serious damage to eyes. S 02 - Keep out of the reach of children. S 20/21 - When using do not eat, drink or smoke. 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 37/39 - Wear suitable gloves and eye/face protection. | |
| 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. | |
| Human Experience: | |
| 8 % solution: no irritation or sensitization. | |
| Oral/Parenteral Toxicity: | |
| gavage-rat LD50 [sex: M] 400 mg/kg (Smyth & Carpenter, 1944) oral-mouse LD50 558 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 29(11), Pg. 51, 1985. intravenous-dog LDLo 200 mg/kg Journal of Pharmacology and Experimental Therapeutics. Vol. 15, Pg. 129, 1920. oral-rat LD50 400 mg/kg Journal of Industrial Hygiene and Toxicology. Vol. 26, Pg. 269, 1944. | |
| Dermal Toxicity: | |
| skin-guinea pig LD50 > 15 ml/kg "Toxicology of Drugs and Chemicals," Deichmann, W.B., New York, Academic Press, Inc., 1969Vol. -, Pg. 695, 1969. subcutaneous-mouse LD50 250 mg/kg Archives Internationales de Pharmacodynamie et de Therapie. Vol. 116, Pg. 154, 1958. | |
| 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 styralyl alcohol usage levels up to: | |||
| 8.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 27.00 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 72.00 (μg/capita/day) | ||
| Threshold of Concern: | 1800 (μg/person/day) | ||
| 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: 3 | |||
| Click here to view publication 3 | |||
| average usual ppm | average maximum ppm | ||
| baked goods: | - | 9.00000 | |
| beverages(nonalcoholic): | - | 4.60000 | |
| beverages(alcoholic): | - | - | |
| breakfast cereal: | - | - | |
| cheese: | - | - | |
| chewing gum: | - | 0.30000 | |
| condiments / relishes: | - | - | |
| confectionery froastings: | - | - | |
| egg products: | - | - | |
| fats / oils: | - | - | |
| fish products: | - | - | |
| frozen dairy: | - | 3.80000 | |
| fruit ices: | - | 3.80000 | |
| gelatins / puddings: | - | 4.00000 | |
| granulated sugar: | - | - | |
| gravies: | - | - | |
| hard candy: | - | 6.80000 | |
| 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: | - | - | |
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): |
| Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 16 (FGE.16): Aromatic ketones from chemical group 21 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) View page or View pdf |
| Flavouring Group Evaluation 16, Revision 1 (FGE.16Rev1)[1]: Aromatic ketones from chemical group 21- Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf |
| Flavouring Group Evaluation 69, (FGE.69)[1] - Consideration of aromatic substituted secondary alcohols, ketones and related esters evaluated by JECFA (57th meeting) structurally related to aromatic ketones from chemical group 21 evaluated by EFSA in FGE.16 (2006) - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food View page or View pdf |
| Flavouring Group Evaluation 16, Revision 2 (FGE.16Rev2): Aromatic ketones from chemical group 21 View page or View pdf |
| Safety and efficacy of aromatic ketones, secondary alcohols and related esters belonging to chemical group 21 when used as flavourings for all animal species View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 69, Revision 1 (FGE.69Rev1): consideration of aromatic substituted secondary alcohols, ketones and related esters evaluated by JECFA (57th meeting), structurally related to aromatic ketones from chemical group 21 evaluated by EFSA in FGE.16Rev2 View page or View pdf |
| EPI System: View |
| Chemical Carcinogenesis Research Information System:Search |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| Carcinogenic Potency Database:Search |
| EPA GENetic TOXicology:Search |
| EPA Substance Registry Services (TSCA):98-85-1 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :7409 |
| National Institute of Allergy and Infectious Diseases:Data |
| WISER:UN 2937 |
| WGK Germany:1 |
| 1-phenylethanol |
| Chemidplus:0000098851 |
| EPA/NOAA CAMEO:hazardous materials |
| RTECS:DO9275000 for cas# 98-85-1 |