| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 547-60-4 |
| ECHA EC Number: | 208-926-9 |
| FDA UNII: | 8W3PLY2V8K |
| Category: | flavor and fragrance agents |
| IUPAC Name: | pinocamphone |
| InChI : | InChI=1/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3 |
| Std.InChI: | InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h6-8H,4-5H2,1-3H3 |
| InChIKey : | MQPHVIPKLRXGDJ-UHFFFAOYAO |
| Std.InChIKey: | MQPHVIPKLRXGDJ-UHFFFAOYSA-N |
| SMILES : | CC1C2CC(C2(C)C)CC1=O |
| Molar Refractivity : | 44.49 ± 0.3 cm3 (est) |
| Parachor : | 366.8 ± 6.0 cm3 (est) |
| Index of Refraction : | 1.467 ± 0.02 (est) |
| Surface Tension : | 27.5 ± 3.0 dyne/cm (est) |
| Density : | 0.950 ± 0.06 g/cm3 (est) |
| Polarizability : | 17.63 ± 0.5 10-24cm3 (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 210.00 to 213.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.177000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 163.00 °F. TCC ( 72.78 °C. ) |
| logP (o/w): | 2.343 (est) |
| Soluble in: | |
| alcohol | |
| water, 199.9 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
| None found |
| None found |
| 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 | |
| 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 | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):547-60-4 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :11038 |
| National Institute of Allergy and Infectious Diseases:Data |
| 2,6,6-trimethylbicyclo[3.1.1]heptan-3-one |
| Chemidplus:0000547604 |
| 2,6,6-trimethylbicyclo[3.1.1]heptan-3-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 547-60-4 |
| Pubchem (cid): | 11038 |
| Pubchem (sid): | 134977623 |
| Pherobase: | View |
| (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 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
| None Found |
| None Found |
| castoreum Search PMC Picture | |
| cistus oil @ 1.5% Data GC Search Trop Picture | |
| cypress cone oil egypt @ 0.1% Data GC Search Trop Picture | |
| hyssop oil @ 18.1% Data GC Search Trop Picture | |
| hyssop oil CO2 extract @ 12.0% Data GC Search Trop Picture | |
| lavender oil spike spain @ 0.04% Data GC Search Trop Picture | |
| lime oil distilled peru @ 0.05% Data GC Search Trop Picture | |
| sage oil dalmatian @ 0.60% Data GC Search Trop Picture | |
| sage oil england @ 1.10% Data GC Search Trop Picture | |
| salvia officinalis oil reunion @ 0.76% Data GC Search Trop Picture | |
| wormwood oil annus france @ 0.00-0.32% Data GC Search Trop Picture |
| bicyclo[3.1.1]heptan-3-one, 2,6,6-trimethyl- | |
| (1)-(1alpha,2alpha, 5alpha)-2,6,6- | trimethyl bicyclo(3.1.1)heptan-3-one |
| (1alpha,2alpha,5alpha)-2,6,6- | trimethyl bicyclo(3.1.1)heptan-3-one |
| (1a,2a,5a)-2,6,6- | trimethylbicyclo(3.1.1)heptan-3-one |
| 2,6,6- | trimethylbicyclo(3.1.1)heptan-3-one |
| 2,6,6- | trimethylbicyclo[3.1.1]heptan-3-one |
