SMILES string
CC(C)[C@@H]1C[C@H](C)CC[C@]21COC3=C4[N+]([C@]5(C[C@H](C)CC[C@H]5C(C)C)CO4)=CN32.O=S([O-])(C(F)(F)F)=O
InChI
1S/C25H41N2O2.CHF3O3S/c1-16(2)20-8-7-19(6)12-25(20)14-29-23-22-26(15-27(23)25)24(13-28-22)10-9-18(5)11-21(24)17(3)4;2-1(3,4)8(5,6)7/h15-21H,7-14H2,1-6H3;(H,5,6,7)/q+1;/p-1/t18-,19-,20+,21+,24-,25-;/m1./s1
InChI key
MXNKPJQKMTUZSH-JSWGGJIYSA-M
assay
95%
optical activity
[α]22/D +31.0°, c = 0.5% in chloroform
mp
216-221 °C
Application
Chiral NHC ligand was reported to ligate to palladium(II) precatalysts for highly stereoselective transformations.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
法规信息
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