| Identification | Back Directory | [Name]
6,6-DiMethyl-3-azabicyclo[3.1.0]hexane Boceprevir Key interMediate | [CAS]
943516-54-9 | [Synonyms]
6,6-DiMethyl-3-azabicyclo[3.1.0]hexane
3-Azabicyclo[3.1.0]hexane, 6,6-dimethyl-
(1R,5S)-6,6-diMethyl-3-azabicyclo[3.1.0]hexane
6,6-DiMethyl-3-azabicyclo[3.1.0]hexane Boceprevir Key interMediate | [EINECS(EC#)]
1308068-626-2 | [Molecular Formula]
C7H13N | [MDL Number]
MFCD13176114 | [MOL File]
943516-54-9.mol | [Molecular Weight]
111.18 |
| Chemical Properties | Back Directory | [Boiling point ]
135℃ | [density ]
0.911 | [Fp ]
24℃ | [storage temp. ]
Keep in dark place,Sealed in dry,2-8°C | [pka]
11.51±0.40(Predicted) | [Appearance]
Colorless to light yellow Liquid | [InChI]
InChI=1S/C7H13N/c1-7(2)5-3-8-4-6(5)7/h5-6,8H,3-4H2,1-2H3 | [InChIKey]
BGOMFPZIMJCRDV-UHFFFAOYSA-N | [SMILES]
C12C(C1(C)C)CNC2 |
| Hazard Information | Back Directory | [Uses]
6,6-DiMethyl-3-azabicyclo[3.1.0]hexane Boceprevir is a Key interMediate. | [Synthesis]
6,6-Dimethyl-3-aza-bicyclo[3.1.01]hexane was synthesised using carbonic anhydride (II) as the starting material. First, in the presence of a nitrogen source, compound II reacted with the catalyst (4-N,N-dimethylaminopyridine) to form the intermediate 6,6-Dimethyl-3-aza-bicyclo[3.1.0]hexane-2,4-dione (III). Finally, compound III was mixed with a THF solution of LiAlH₄ to continue the reaction. The reaction route is as follows:
![synthesis of 6,6-Dimethyl-3-aza-bicyclo[3.1.01]hexane](/NewsImg/2025-12-30/6390271125377549316037104.png "synthesis of 6,6-Dimethyl-3-aza-bicyclo[3.1.01]hexane") |
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