LN-085530
2-(bis(tert-butoxycarbonyl)amino)-5-bromopyridin-3-yl4-methylbenzenesulfonate , 1803573-21-8
CAS NO.：1803573-21-8
Empirical Formula: C22H27BrN2O7S
Molecular Weight: 543.43
MDL number: MFCD33551657
Update time: 2023-04-23
PRODUCT Properties
| Boiling point: | 592.6±60.0 °C(Predicted) |
| Density | 1.408±0.06 g/cm3(Predicted) |
| pka | -2.81±0.10(Predicted) |
| InChI | InChI=1S/C22H27BrN2O7S/c1-13-8-9-17(33(28,29)30)15(10-13)16-11-14(23)12-24-18(16)25(19(26)31-21(2,3)4)20(27)32-22(5,6)7/h8-12H,1-7H3,(H,28,29,30)/p-1 |
| InChIKey | JSLQOXRDSUEVAA-UHFFFAOYSA-M |
| SMILES | C1(S([O-])(=O)=O)=CC=C(C)C=C1C1=CC(Br)=CN=C1N(C(OC(C)(C)C)=O)C(OC(C)(C)C)=O |