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peony acetonitrile
General Material Information
| Preferred name | peony acetonitrile |
| Trivial Name | 2-cyclohexylidene-2-phenylacetonitrile |
| Short Description | peonile (Givaudan) |
| Formula | C14 H15 N |
| CAS Number | 10461-98-0 |
| FDA UNII | Search |
| Nikkaji Number | J2.470.173E |
| xLogP3-AA | 3.60 (est) |
| Bio Activity Summary | External link |
| NMR Predictor | External link |
| 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
| 2-cyclohexylidene-2-phenylacetonitrile | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 66327 |
| Pubchem (sid): | 135026097 |
| Publications by US Patents | |
| 6,069,125 - Nitrile | |
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 |
| HMDB (The Human Metabolome Database): | Search |
| ChemSpider: | View |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 197.2805480957 |
| Boiling Point | 350 to 351°C @ 760 mm Hg |
| Vapor Pressure | 4.2E-5 mmHg @ 25 °C |
| Flash Point TCC Value | 120 °C TCC |
| logP (o/w) | 3.851 est |
| Solubility | |
| alcohol | Yes |
| water, 7.5 mg/L @ 20 °C (exp) | Yes |
| Stability | |
| alcoholic - good | Unspecified |
| antiperspirant spray - good | Unspecified |
| APC (pH = 10) - good | Unspecified |
| candles - good | Unspecified |
| damp fabric - good | Unspecified |
| dry fabric - good | Unspecified |
| liquid bleach - moderate | Unspecified |
| pH = 2 - good | Unspecified |
| powder detergent - good | Unspecified |
| powder detergent + activator - good | Unspecified |
| soap - good | Unspecified |
| toiletries - good | Unspecified |
Organoleptic Properties
| Odor Type: Floral | |
| peony, floral, geranium, grapefruit, fresh | |
| Odor strength | medium |
| Substantivity | 400 hour(s) at 100.00 % |
| General comment | At 100.00 %. floral geranium grapefruit fresh |
| Peonile, with its geranium-rosy character, gives interesting combinations in floral, fougère or hesperidian accords. Peonile is powerful, relatively non-volatile and is very stable in almost all media. It has very high substantivity on wet and dry laundry and helps to increase volume and tenacity in functional perfumes. | Floral, Geranium, Grapefruit, Fresh |
| Writing in 1999 Arcadi Boix Camps says it “is an extremely good chemical smelling of geranium, rose and other flowers. It is incredibly effective as a floralizer on powder detergent and soap fragrances and provides a harmony not easily acheived with other chemicals. It remains captive and is missing from most laboratories, but I believe it will come to be used more and more because of its outstanding and impressive properties” | Floral-rose and geranium, green-citrus. Substantive and Fixative |
Potential Uses
| Applications | |
| Odor purposes | Aldehydic , Autumn , Azalea , Bouquet , Carnation , Chamomile , Citrus , Clove blossom , Currant bud absolute replacer , Dahlia , Daisy , Daphne , Davana oil replacer , Elder berry , Fagonia , Fern , Floral , Foliage , Fruit , Geranium , Green , Guava , Hyacinth , Hydrangea , Leather , Lily of the valley , Millefleurs , Moss , Musk , Peony , Peppermint , Petunia , Phlox , Poppy , Rain , Reseda , Rose , Rose absolute replacer , Rose d'orient , Rose dog rose , Rose geranium , Rose moss rose , Rose red rose , Rose tea rose , Rose white rose , Rosemary , Scented stock , Stephanotis , Tobacco , Tulip |
| Flavoring purposes | Currant bud absolute replacer |
| Other purposes | Fantasy blends |
Safety Information
Safety information
| European information : | |
| Most important hazard(s): | |
| Xn N - Harmful, Dangerous for the environment. | |
| R 22 - Harmful if swallowed. R 50/53 - Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing. S 60 - This material and its container must be disposed of as hazardous waste. S 61 - Avoid release to the environment. Refer to special instructions/safety data sheet. | |
| 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 | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in use information
| Category: | |||
| 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 peony acetonitrile usage levels up to: | |||
| 10.0000 % in the fragrance concentrate. | |||
| Recommendation for peony acetonitrile flavor usage levels up to: | |||
| not for flavor use. | |||
Safety references
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):10461-98-0 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :66327 |
| National Institute of Allergy and Infectious Diseases:Data |
| WISER:UN 3082 |
| WGK Germany:2 |
| 2-cyclohexylidene-2-phenylacetonitrile |
| Chemidplus:0010461980 |