Ethyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarboxylate → 1-{4'-[4-(2-Benzylsulfanyl-ethyl)-3-methyl-isoxazol-5-yl]-biphenyl-4-yl}-cyclopropanecarboxylic acid ethyl ester
Reaktionsgleichung
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8][CH2:9][CH2:10][c:11]1[c:12]([CH3:23])[n:13][o:14][c:15]1-[c:16]1[cH:17][cH:18][c:19]([Br:22])[cH:20][cH:21]1.[CH2:24]([CH3:25])[O:26][C:27](=[O:28])[C:29]1([c:32]2[cH:33][cH:34][c:35]([B:38]3[O:39][C:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[O:46]3)[cH:36][cH:37]2)[CH2:30][CH2:31]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[S:8][CH2:9][CH2:10][c:11]1[c:12]([CH3:23])[n:13][o:14][c:15]1-[c:16]1[cH:17][cH:18][c:19](-[c:35]2[cH:34][cH:33][c:32]([C:29]3([C:27]([O:26][CH2:24][CH3:25])=[O:28])[CH2:30][CH2:31]3)[cH:37][cH:36]2)[cH:20][cH:21]1Komponenten
3
Edukt 2
Produkt 1
Quellen und Nachweise
- ORD-Eintrag
- ord-8e772831c7c148b396211947d42b98dd
- Quelldatensatz
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)