Introduction:Basic information about CAS 1256387-87-7|(1R,3S,4S)-3-[6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-BENZIMIDAZOL-2-YL], including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (1R,3S,4S)-3-[6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-BENZIMIDAZOL-2-YL]-2-AZABICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER |
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| CAS Number | 1256387-87-7 | Molecular Weight | 439.355 |
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| Density | 1.2±0.1 g/cm3 | Boiling Point | 613.5±35.0 °C at 760 mmHg |
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| Molecular Formula | C24H34BN3O4 | Melting Point | / |
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| MSDS | / | Flash Point | 324.8±25.9 °C |
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Names
| Name | (1R,3S,4S)-3-[6-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazol-2-yl]-2-azabicyclo[2.2.1]heptane-2-carboxylic acid 1,1-dimethylethyl ester |
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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 | 613.5±35.0 °C at 760 mmHg |
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| Molecular Formula | C24H34BN3O4 |
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| Molecular Weight | 439.355 |
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| Flash Point | 324.8±25.9 °C |
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| Exact Mass | 439.264252 |
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| PSA | 76.68000 |
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| LogP | 4.26050 |
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| Vapour Pressure | 0.0±1.8 mmHg at 25°C |
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| Index of Refraction | 1.583 |
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| InChIKey | MYPUONINDNZBTH-GMBSWORKSA-N |
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| SMILES | CC(C)(C)OC(=O)N1C2CCC(C2)C1c1nc2ccc(B3OC(C)(C)C(C)(C)O3)cc2[nH]1 |
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Synonyms
| 2-Methyl-2-propanyl (1R,3S,4S)-3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazol-2-yl]-2-azabicyclo[2.2.1]heptane-2-carboxylate |
| Ledipasvir Intermediate 09 |
| (1R,3S,4S)-tert-butyl 3-(6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1Hbenzo[d]imidazol-2-yl)-2-azabicyclo[2.2.1]heptane-2-carboxylate |
| (1R,3S,4S)-2-tert-butoxycarbonyl-3-(6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzo[d]imidazol-2-yl)-2-azabicyclo[2.2.1]heptane |
| 2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazol-2-yl]-, 1,1-dimethylethyl ester, (1R,3S,4S)- |
| 3-[6-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-1H-benzoimidazol-2-yl]-2-aza-bicyclo[2.2.1]heptane-2-carboxylic acid tert-butyl ester |