Introduction：Basic information about CAS 709031-43-6|N-[(1S)-2-[(1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxytricyc, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | N-[(1S)-2-[(1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxytricyclo[3.3.1.13,7]dec-1-yl)-2-oxoethyl]carbamic acid 1,1-dimethylethyl ester |
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| CAS Number | 709031-43-6 | Molecular Weight | 415.526 |
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| Density | 1.3±0.1 g/cm3 | Boiling Point | 624.7±40.0 °C at 760 mmHg |
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| Molecular Formula | C23H33N3O4 | Melting Point | / |
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| MSDS | / | Flash Point | 331.6±27.3 °C |
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Names
| Name | tert-butyl N-[2-(3-cyano-2-azabicyclo[3.1.0]hexan-2-yl)-1-(3-hydroxy-1-adamantyl)-2-oxoethyl]carbamate |
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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 | 624.7±40.0 °C at 760 mmHg |
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| Molecular Formula | C23H33N3O4 |
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| Molecular Weight | 415.526 |
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| Flash Point | 331.6±27.3 °C |
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| Exact Mass | 415.247101 |
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| PSA | 106.15000 |
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| LogP | 1.64 |
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| Vapour Pressure | 0.0±4.1 mmHg at 25°C |
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| Index of Refraction | 1.594 |
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| InChIKey | DZEAFYQJPRVNIQ-CBFGHZPDSA-N |
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| SMILES | CC(C)(C)OC(=O)NC(C(=O)N1C(C#N)CC2CC21)C12CC3CC(CC(O)(C3)C1)C2 |
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Synonyms
| tert-butyl N-[(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hexan-2-yl]-1-[(5R,7S)-3-hydroxy-1-adamantyl]-2-oxoethyl]carbamate |
| 2-Methyl-2-propanyl [(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxyadamantan-1-yl)-2-oxoethyl]carbamate |
| L66 B6/B-H/DI A B- C 1B ITJ BQ DYMVOX1&1&1&V- DT35 DNTJ ECN &&[(S)-2-(1S,3S,5S)- Form |
| N-[(1S)-2-[(1S,3S,5S)-3-Cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxytricyclo[3.3.1.1]dec-1-yl)-2-oxoethyl]carbamic acid, 1,1-dimethylethyl ester |
| 1,1-Dimethylethyl N-[(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxytricyclo[3.3.1.1]dec-1-yl)-2-oxoethyl]carbamate |
| (S)-N-Boc-3-hydroxyadamantylglycine-L-cis-4,5-methanoprolinenitrile |
| N-[(1S)-2-[(1S,3S,5S)-3-CYANO-2-AZABICYCLO[3.1.0]HEX-2-YL]-1-(3-HYDROXYTRICYCLO[3.3.1.13,7]DEC-1-YL)-2-OXOETHYL]CARBAMIC ACID 1,1-DIMETHYLETHYL ESTER |
| (1S,3S,5S)-2-[(2S)-2-[(1,1-dimethoxy)carbonyl]amino-2-(3-hydroxy-1-adamantyl)acetyl]-2-azabicyclo[3.1.0]hexane-3-carbonitrile |
| [(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxy-tricyclo[3.3.1.13,7]dec-1-yl)-2-oxoethyl]-carbamic acid 1,1-dimethyl-ethyl ester |
| Boc-saxagliptin |
| Carbamic acid, N-[(1S)-2-[(1S,3S,5S)-3-cyano-2-azabicyclo[3.1.0]hex-2-yl]-1-(3-hydroxytricyclo[3.3.1.1]dec-1-yl)-2-oxoethyl]-, 1,1-dimethylethyl ester |
