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rose acetate
General Material Information
| Preferred name | rose acetate |
| Trivial Name | Rosephenone |
| Short Description | rose crystals |
| Formula | C10 H9 Cl3 O2 |
| CAS Number | 90-17-5 |
| Deleted CAS Number | 39347-18-7 |
| ECHA Number | 201-972-0 |
| FDA UNII | 4VE62Y0O29 |
| Nikkaji Number | J50.598F |
| Beilstein Number | 2270144 |
| MDL | MFCD00000804 |
| xLogP3-AA | 3.50 (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 |
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 |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2915.40.0000 |
| ChemSpider: | View |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 267.5361328125 |
| Melting Point | 188 to 191°C @ 760 mm Hg |
| Vapor Pressure | 4.2E-5 mmHg @ 25 °C |
| Flash Point TCC Value | 100 °C TCC |
| logP (o/w) | 3.527 est |
| Solubility | |
| alcohol | Yes |
| water, 9.645 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Floral | |
| rose, floral, powdery, balsamic, soapy | |
| Odor strength | medium , recommend smelling in a 10.00 % solution or less |
| Substantivity | 400 hour(s) at 20.00 % in dipropylene glycol |
| Luebke, William tgsc, (1982) | At 10.00 % in dipropylene glycol. heavy deep rose floral powdery balsamic soapy |
| Blends-well-with - +Aldehyde C11 undecylenic | Heavy floral powdery rose |
| Arctander says that this material “has found wide application in perfume compositions as a fixative in Rose and Geranium compounds, soap fragrances, powder perfumes, etc. because of its excellent stability and fixative effect. Its odor is better understood upon evaluation of Phenylethylalcohol with and without 5% of this material. There are still perfumers who find the title ester odorless or without any perfumery value, and it is sometimes because the material has been judged too hastily without a compounding experiment. | Mild, floral-rose, balsamic |
| General comment | Floral, Sweet powdery Balsamic |
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 , Floral , Foliage , Fruit , Geranium , Green , Guava , Hyacinth , Hydrangea , Leather , Lily of the valley , Millefleurs , Moss , Musk , Peony , Peppermint , Petunia , Phlox , Poppy , Powder , 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 , Wisteria |
| Flavoring purposes | Currant bud absolute replacer |
| Other purposes | Fantasy blends , Fixer , Metal by paco rabanne |
| Cosmetic purposes | Perfuming agents |
Safety Information
Safety information
| European 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. | |
| 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: | |
| 1 % solution: no irritation or sensitization. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 6800 mg/kg Food and Cosmetics Toxicology. Vol. 13, Pg. 919, 1975. | |
| Dermal Toxicity: | |
| skin-rabbit LD50 > 2000 mg/kg Food and Cosmetics Toxicology. Vol. 13, Pg. 919, 1975. | |
| 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 rose acetate usage levels up to: | |||
| 0.8000 % in the fragrance concentrate. | |||
| Recommendation for rose acetate 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):90-17-5 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :7007 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| (2,2,2-trichloro-1-phenylethyl) acetate |
| Chemidplus:0000090175 |
| RTECS:AJ8375000 for cas# 90-17-5 |