2742706-71-2
| Name | 3-Azabicyclo[3.1.0]hexane-2-carboxylic acid, 3-[(2S)-3,3-dimethyl-1-oxo-2-[(2,2,2-trifluoroacetyl)amino]butyl]-6,6-dimethyl-, methyl ester, (1R,2S,5S)- |
| CAS | 2742706-71-2 |
| Molecular Formula | C17H25F3N2O4 |
| Molecular Weight | 378.39 |
| MOL File | 2742706-71-2.mol |
Chemical Properties
| Boiling point | 450.7±45.0 °C(Predicted) |
| density | 1.230±0.06 g/cm3(Predicted) |
| pka | 10.26±0.46(Predicted) |
| InChI | InChI=1S/C17H25F3N2O4/c1-15(2,3)11(21-14(25)17(18,19)20)12(23)22-7-8-9(16(8,4)5)10(22)13(24)26-6/h8-11H,7H2,1-6H3,(H,21,25)/t8-,9-,10-,11+/m0/s1 |
| InChIKey | GJHCWCVNORDLJM-XWLWVQCSSA-N |
| SMILES | [C@@]12([H])[C@@]([H])(C1(C)C)CN(C(=O)[C@@H](NC(C(F)(F)F)=O)C(C)(C)C)[C@@H]2C(OC)=O |