Methanol → HCID 44599682, compound

HRID 1236345Notes

Reaction equation

HRID 1236345 reaction equation
[C:48]([BH3-:49])#[N:50].[CH3:37][c:38]1[cH:39][cH:40][c:41]([S:42]([OH:43])(=[O:44])=[O:45])[cH:46][cH:47]1.[CH3:59][OH:60].[CH:52]([Cl:53])([Cl:54])[Cl:55].[Cl:56][CH2:57][Cl:58].[F:1][c:2]1[cH:3][c:4]([CH2:26][CH:27]=[O:28])[cH:5][cH:6][c:7]1-[c:8]1[s:9][c:10]2[n:11][c:12]([C:17]3([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:18][CH2:19]3)[cH:13][cH:14][c:15]2[n:16]1.[NH2:29][CH2:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[Na+:51]>>[F:1][c:2]1[cH:3][c:4]([CH2:26][CH2:27][NH:29][CH2:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:5][cH:6][c:7]1-[c:8]1[s:9][c:10]2[n:11][c:12]([C:17]3([c:20]4[cH:21][cH:22][cH:23][cH:24][cH:25]4)[CH2:18][CH2:19]3)[cH:13][cH:14][c:15]2[n:16]1

Participants

9

Reactant 8

HCID 887MethanolHCID 923Sodium ionHCID 6101p-Toluenesulfonic acidHCID 6212ChloroformHCID 6344DichloromethaneHCID 7504BenzylamineHCID 498716Cyano-borohydrideHCID 86638722HCID 86638722, compound

Product 1

HCID 44599682HCID 44599682, compound

Sources & evidence

ORD record
ord-d0d0ec4004784e86b269151e8124c43f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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