Introduction：Basic information about CAS 1214741-21-5|(3R,7aR)-3-tert-butyl-7a-vinyl-dihy dropyrrolo[1,2-c]ox azole-1,5 (3H,6H)-dione, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3R,7aR)-3-tert-butyl-7a-vinyl-dihy dropyrrolo[1,2-c]ox azole-1,5 (3H,6H)-dione |
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| CAS Number | 1214741-21-5 | Molecular Weight | 225.284 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 348.9±42.0 °C at 760 mmHg |
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| Molecular Formula | C12H19NO3 | Melting Point | / |
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| MSDS | / | Flash Point | 164.8±27.9 °C |
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Names
| Name | (3R,7aR)-3-(tert-butyl)-1-hydroxy-7a-vinyltetrahydro-3H,5H-pyrrolo[1,2-c]oxazol-5-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.2±0.1 g/cm3 |
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| Boiling Point | 348.9±42.0 °C at 760 mmHg |
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| Molecular Formula | C12H19NO3 |
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| Molecular Weight | 225.284 |
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| Flash Point | 164.8±27.9 °C |
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| Exact Mass | 225.136490 |
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| PSA | 49.77000 |
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| LogP | 0.38 |
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| Vapour Pressure | 0.0±1.7 mmHg at 25°C |
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| Index of Refraction | 1.536 |
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| InChIKey | DAGVYBNUTMALEB-MAZPRZIYSA-N |
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| SMILES | C=CC12CCC(=O)N1C(C(C)(C)C)OC2O |
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Synonyms
| 3H,5H-Pyrrolo[1,2-c]oxazol-5-one, 3-(1,1-dimethylethyl)-7a-ethenyltetrahydro-1-hydroxy-, (3R,7aR)- |
| (3R,7aR)-1-Hydroxy-3-(2-methyl-2-propanyl)-7a-vinyltetrahydro-5H-pyrrolo[1,2-c][1,3]oxazol-5-one |
| (3R,7aR)-3-tert-butyl-7a-vinyl-dihy dropyrrolo[1,2-c]ox azole-1,5 (3H,6H)-dione |
| Rolapitant Intermediate 1 |
