| 2D: |  |
|---|---|
| 3D: | |
| CAS Number: | 17677-87-1 |
| FDA UNII: | Search |
| Category: | natural substances and extractives |
| IUPAC Name: | pulegone oxide |
| InChI : | InChI=1/C10H16O2/c1-7-4-5-10(8(11)6-7)9(2,3)12-10/h7H,4-6H2,1-3H3 |
| Std.InChI: | InChI=1S/C10H16O2/c1-7-4-5-10(8(11)6-7)9(2,3)12-10/h7H,4-6H2,1-3H3 |
| InChIKey : | OFUGTKAUAMKFPM-UHFFFAOYAJ |
| Std.InChIKey: | OFUGTKAUAMKFPM-UHFFFAOYSA-N |
| SMILES : | CC1CCC2(C(=O)C1)C(O2)(C)C |
| Molar Refractivity : | 46.10 ± 0.4 cm3 (est) |
| Parachor : | 387.5 ± 6.0 cm3 (est) |
| Index of Refraction : | 1.483 ± 0.03 (est) |
| Surface Tension : | 33.3 ± 5.0 dyne/cm (est) |
| Density : | 1.04 ± 0.1 g/cm3 (est) |
| Polarizability : | 18.27 ± 0.5 10-24cm3 (est) |
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 245.00 to 246.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.029000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 208.00 °F. TCC ( 98.00 °C. ) (est) |
| logP (o/w): | 1.278 (est) |
| Soluble in: | |
| alcohol | |
| water, 3799 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: | |||
| natural substances and extractives | |||
| Recommendation for pulegone oxide usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for pulegone oxide flavor usage levels up to: | |||
| not for flavor use. | |||
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :330109 |
| National Institute of Allergy and Infectious Diseases:Data |
| 1,1,6-trimethyl-2-oxaspiro[2.5]octan-8-one |
| Chemidplus:0017677871 |
| 1,1,6-trimethyl-2-oxaspiro[2.5]octan-8-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 330109 |
| Pubchem (sid): | 135238534 |
| (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 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| None Found |
| None Found |
| cis-4,8- | epoxy-p-menthan-3-one |
| cis-4,8- | epoxy-para-menthan-3-one |
| 2,2,6- | trimethyl-1-oxaspiro(2.5)octan-4-one |
| 2,2,6- | trimethyl-1-oxaspiro[2.5]octan-4-one |
| 1,1,6- | trimethyl-2-oxaspiro[2.5]octan-8-one |
