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piperitone
General Material Information
| Preferred name | piperitone |
| Trivial Name | (±)-Piperitone |
| Short Description | 2-cyclohexen-1-one, 3-methyl-6-(1-methylethyl)- |
| Formula | C10 H16 O |
| CAS Number | 89-81-6 |
| Flavis Number | 7.175 |
| ECHA Number | 201-942-7 |
| FDA UNII | 1VZ8RG269R |
| Nikkaji Number | J4.308G |
| Beilstein Number | 1907772 |
| MDL | MFCD00045532 |
| COE Number | 2052 |
| xLogP3-AA | 2.20 (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
| 3-methyl-6-propan-2-ylcyclohex-2-en-1-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 89-81-6 |
| Pubchem (cid): | 6987 |
| Pubchem (sid): | 134972994 |
| Flavornet: | 89-81-6 |
| 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 |
| CHEBI: | View |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | HMDB34975 |
| FooDB: | FDB013573 |
| Export Tariff Code: | 2914.29.5000 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
Suppliers
PhysChem Properties
| Material listed in food chemical codex | No |
| Molecular weight | 152.23672485352 |
| Specific gravity | @ 25 °C |
| Pounds per Gallon | 7.73 to 7.772 |
| Refractive Index | 1.483 to 1.487 @ 20 °C |
| Optical Rotation | -40 to -49 |
| Boiling Point | 233 to 235°C @ 760 mm Hg |
| Vapor Pressure | 0.057 mmHg @ 25 °C |
| Flash Point TCC Value | 97.78 °C TCC |
| logP (o/w) | 2.85 |
| Solubility | |
| alcohol | Yes |
| water, very slightly | Yes |
| water, 273.1 mg/L @ 25 °C (est) | Yes |
| water | No |
| Stability | |
| detergent | Unspecified |
| fabric softener | Unspecified |
| soap | Unspecified |
Organoleptic Properties
| Odor Type: Herbal | |
| herbal, minty, camphoreous, medicinal | |
| Luebke, William tgsc, (1994) | At 10.00 % in dipropylene glycol. herbal minty camphor medicinal |
| Flavor Type: Minty | |
| minty, cooling, mentholic, spicy, peppermint, peppery | |
| Luebke, William tgsc, (1994) | Minty cooling mentholic spicy peppermint peppery |
Occurrences
| (data available) |
Potential Uses
| Applications | |
| Odor purposes | Camphor tree bark , Eucalyptus oil replacer , Herbal , Mint |
| Flavoring purposes | Camphor tree bark |
| Cosmetic purposes | Perfuming agents |
Safety Information
Safety information
| Preferred SDS: View | |
| 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 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. | |
| Oral/Parenteral Toxicity: | |
| oral-rat LD50 2450 mg/kg Food and Cosmetics Toxicology. Vol. 16, Pg. 863, 1978. | |
| Dermal Toxicity: | |
| subcutaneous-mouse LD50 1420 mg/kg BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Food and Cosmetics Toxicology. Vol. 16, Pg. 863, 1978. | |
| 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 piperitone usage levels up to: | |||
| 3.0000 % in the fragrance concentrate. | |||
| Maximised Survey-derived Daily Intakes (MSDI-EU): | 44.00 (μg/capita/day) | ||
| Maximised Survey-derived Daily Intakes (MSDI-USA): | 10.00 (μg/capita/day) | ||
| Structure Class: | II | ||
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): |
| Flavouring Group Evaluation 212: alpha,beta-Unsaturated alicyclic ketones and precursors from chemical subgroup 2.6 of FGE.19 View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 212 Revision 1 (FGE.212Rev1): alpha,beta-Unsaturated alicyclic ketones and precursors from chemical subgroup 2.6 of FGE.19. View page or View pdf |
| Scientific Opinion on Flavouring Group Evaluation 212 Revision 3 (FGE.212Rev3): a,ß-unsaturated alicyclic ketones and precursors from chemical subgroup 2.6 of FGE.19 View page or View pdf |
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):89-81-6 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :6987 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:1 |
| 3-methyl-6-propan-2-ylcyclohex-2-en-1-one |
| Chemidplus:0000089816 |
| RTECS:OT0257000 for cas# 89-81-6 |