| Category: | information only not used for fragrances or flavors |
|---|---|
| IUPAC Name: | 1-(2-tert-butyl cyclohexyl)-4-(pyrrolidine-1-carbonyl) pyrrolidin-2-one |
| InChI : | InChI=1/C19H32N2O2/c1-19(2,3)15-8-4-5-9-16(15)21-13-14(12-17(21)22)18(23)20-10-6-7-11-20/h14-16H,4-13H2,1-3H3 |
| Std.InChI: | InChI=1S/C19H32N2O2/c1-19(2,3)15-8-4-5-9-16(15)21-13-14(12-17(21)22)18(23)20-10-6-7-11-20/h14-16H,4-13H2,1-3H3 |
| InChIKey : | WWYCTYUMKRZSNW-UHFFFAOYAT |
| Std.InChIKey: | WWYCTYUMKRZSNW-UHFFFAOYSA-N |
| SMILES : | CC(C)(C)C1CCCCC1N2CC(CC2=O)C(=O)N3CCCC3 |
| Molar Refractivity : | 90.63 ± 0.3 cm3 (est) |
| Parachor : | 755.8 ± 6.0 cm3 (est) |
| Index of Refraction : | 1.538 ± 0.02 (est) |
| Surface Tension : | 46.3 ± 3.0 dyne/cm (est) |
| Density : | 1.106 ± 0.06 g/cm3 (est) |
| Polarizability : | 35.93 ± 0.5 10-24cm3 (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Soluble in: | |
| water, 11.13 mg/L @ 25 °C (est) | |
| 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: | |||
| information only not used for fragrances or flavors | |||
| Recommendation for 1-(2-tert-butyl cyclohexyl)-4-(pyrrolidine-1-carbonyl) pyrrolidin-2-one usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 1-(2-tert-butyl cyclohexyl)-4-(pyrrolidine-1-carbonyl) pyrrolidin-2-one flavor usage levels up to: | |||
| not for flavor use. | |||
| 1-(2-tert-butylcyclohexyl)-4-(pyrrolidine-1-carbonyl)pyrrolidin-2-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 69670058 |
| Pubchem (cas): | NF0575 |
| (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 |
| None Found |
| None Found |
| not found in nature |
| 1-(2-tert- | butyl-cyclohexyl)-4-(pyrrolidine-1-carbonyl)-pyrrolidin-2-one |
| 1-(2-tert- | butylcyclohexyl)-4-(pyrrolidine-1-carbonyl)pyrrolidin-2-one |
