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orange nitrile
General Material Information
| Preferred name | orange nitrile |
| Trivial Name | 3-Methyldodecanenitrile |
| Short Description | frescile (Givaudan) |
| Formula | C13 H25 N |
| CAS Number | 85351-07-1 |
| ECHA Number | 286-729-7 |
| FDA UNII | Search |
| Nikkaji Number | J310.320J |
| xLogP3-AA | 5.60 (est) |
| 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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2926.90.0000 |
| ChemSpider: | View |
Suppliers
| Givaudan | Lluch Essence |
| Moellhausen | Vigon International |
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 195.34924316406 |
| Boiling Point | 284 to 285°C @ 760 mm Hg |
| Vapor Pressure | 0.003 mmHg @ 25 °C |
| Flash Point TCC Value | 81.11 °C TCC |
| logP (o/w) | 5.115 est |
| Shelf life | 24 months (or longer if stored properly.) |
| Storage notes | Store in cool, dry place in tightly sealed containers, protected from heat and light. |
| Solubility | |
| alcohol | Yes |
| water, 0.9404 mg/L @ 25 °C (est) | Yes |
| water | No |
Organoleptic Properties
| Odor Type: Citrus | |
| orange, green, marine, algae, watery, cloth laundered cloth, oily | |
| Odor strength | medium , recommend smelling in a 1.00 % solution or less |
| Substantivity | 140 hour(s) at 100.00 % |
| Luebke, William tgsc, (1989) | At 1.00 % in dipropylene glycol. orange green sea algae watery clean cloths oily |
| Frescile has very powerful citrus zest note, with a mandarine freshness and shades of aldehydic character. A 10% dilution is recommended at 1 or 2% to support and enhance citrus and marine freshness. The neat material is used particularly in hostile applications, where the options such as stable citrus notes are more limited. | Aldehyde, Citrus, Mandarine |
| General comment | Aldehyde, Citrus, Mandarine |
Potential Uses
| Applications | |
| Odor purposes | Algae , Bergamot , Green , Ocean sea |
| Other purposes | Enhancer , Modifier , Topnotes |
| Cosmetic purposes | Perfuming agents |
Safety Information
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 | |
| 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 orange nitrile usage levels up to: | |||
| 2.0000 % in the fragrance concentrate. | |||
| Recommendation for orange nitrile 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):85351-07-1 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :11970928 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| 3-methyldodecanonitrile |
| Chemidplus:0085351071 |