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grapefruit pentanol
General Material Information
| Preferred name | grapefruit pentanol |
| Trivial Name | 2-Methyl-4-phenyl-1-pentanol |
| Short Description | pamplefleur (IFF) |
| Formula | C12 H18 O |
| CAS Number | 92585-24-5 |
| FDA UNII | Search |
| Nikkaji Number | J3.308.943K |
| xLogP3-AA | 3.00 (est) |
| NMR Predictor | External link |
| Applications |
|
| Synonyms |
|
Organoleptic Properties
| Odor Type: Citrus | |
| Odor strength | medium |
| Substantivity | 348 hour(s) at 100.00 % |
| Luebke, William tgsc, (2007) | At 100.00 %. vetiver green citrus grapefruit rhubarb floral |
| General comment | The animalic moiety for jasmin types. Citrus, Grapefruit, vetiver, fresh note |
Potential Uses
| Odor purposes | Abronia , Agrumen aldehyde , Aldehydic , Almond , Alpine bouquet , Amaryllis , Animal , Apple , Apple blossom , Crabapple , Apricot , Ash mountain ash berry , Bergamot , Blackberry , Bouquet , Bramble arctic bramble blackberry , Cabreuva wood , Calamus oil replacer , Cherry blossom , Chypre , Cilantro , Citrus , Cologne , Colonia , Crabapple blossom , Cranberry , Curacao , Daffodil , Elder berry , Fig , Fir needle oil replacer , Floral , Forest , Freesia , Gardenia , Grapefruit , Green , Heather , Herbal , Hibiscus , Hinoki oil replacer , Jasmin , Kumquat , Lemon , Linden flower , Lotus , Mandarin , Melissa oil replacer , Mock orange , Neroli , Orange bitter orange peel , Orange blossom , Papaya , Passion fruit , Pear , Petitgrain , Petitgrain bergamot petitgrain , Petitgrain mandarin oil replacer , Petitgrain orange petitgrain , Petitgrain tangerine petitgrain , Pine , Pineapple , Pomegranate , Rhubarb , Saffron , Spice , Spring rain , Verbena , Vetiver , Woody |
| Flavoring purposes | Cherry wild cherry , Cilantro , Cloudberry bakeapple , Nectarine , Orange bitter orange peel , Petitgrain bergamot petitgrain , Petitgrain mandarin oil replacer , Petitgrain tangerine petitgrain , Starfruit , Tamarind , Tea , Tropical |
| Other purposes | Rose wild rose , Watercress nasturtium |
| Cosmetic purposes | Perfuming agents |
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 |
| 2-methyl-4-phenylpentan-1-ol | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 92585-24-5 |
| Pubchem (cid): | 3021997 |
| Pubchem (sid): | 135195961 |
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: | 2906.29.0000 |
| ChemSpider: | View |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 178.27465820312 |
| Boiling Point | 274 to 275°C @ 760 mm Hg |
| Vapor Pressure | 0.003 mmHg @ 25 °C |
| Flash Point TCC Value | 103.89 °C TCC |
| logP (o/w) | 3.245 |
| Shelf life | 36 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, 234 mg/L @ 25 °C (est) | Yes |
| Stability | |
| acid cleaner | Unspecified |
| alcoholic lotion | Unspecified |
| antiperspirant | Unspecified |
| deo stick | Unspecified |
| detergent | Unspecified |
| fabric softener | Unspecified |
| hard surface cleaner | Unspecified |
| shampoo | Unspecified |
| soap | Unspecified |
Safety Information
Safety information
| European information : | |
| Most important hazard(s): | |
| Xi - Irritant | |
| R 36/38 - Irritating to skin and eyes. R 43 - May cause sensitisation by skin contact. 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: | |
| skin sensitizer | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 > 3000 mg/kg | |
| Dermal Toxicity: | |
| skin-rabbit LD50 3000 mg/kg | |
| 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 grapefruit pentanol usage levels up to: | |||
| 2.0000 % in the fragrance concentrate. | |||
| Recommendation for grapefruit pentanol 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):92585-24-5 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :3021997 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:2 |
| 2-methyl-4-phenylpentan-1-ol |
| Chemidplus:0092585245 |