Introduction：Basic information about CAS 781650-41-7|(3R,6S)-3-amino-6-(2,3-difluorophenyl)-1-(2,2,2-trifluoroethyl)azepan-2-one, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3R,6S)-3-amino-6-(2,3-difluorophenyl)-1-(2,2,2-trifluoroethyl)azepan-2-one |
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| CAS Number | 781650-41-7 | Molecular Weight | 322.274 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 367.6±42.0 °C at 760 mmHg |
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| Molecular Formula | C14H15F5N2O | Melting Point | / |
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| MSDS | / | Flash Point | 176.1±27.9 °C |
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Names
| Name | (3R,6S)-3-amino-6-(2,3-difluorophenyl)-1-(2,2,2-trifluoroethyl)azepan-2-one |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.3±0.1 g/cm3 |
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| Boiling Point | 367.6±42.0 °C at 760 mmHg |
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| Molecular Formula | C14H15F5N2O |
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| Molecular Weight | 322.274 |
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| Flash Point | 176.1±27.9 °C |
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| Exact Mass | 322.110443 |
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| PSA | 46.33000 |
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| LogP | 2.34 |
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| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
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| Index of Refraction | 1.474 |
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| InChIKey | COZIJLDLJMKBRZ-LDYMZIIASA-N |
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| SMILES | NC1CCC(c2cccc(F)c2F)CN(CC(F)(F)F)C1=O |
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Synonyms
| (3R,6S)-3-Amino-6-(2,3-difluorophenyl)-1-(2,2,2-trifluoroethyl)-2-azepanone |
| (3R,6S)-3-Amino-6-(2,3-difluorphenyl)-1-(2,2,2-trifluorethyl)azepan-2-on |
| 2H-Azepin-2-one, 3-amino-6-(2,3-difluorophenyl)hexahydro-1-(2,2,2-trifluoroethyl)-, (3R,6S)- |
| (3R,6S)-3-amino-6-(2,3-difluorophenyl)-1-(2,2,2-trifluoroethyl)azepan-2-one |
