Diethyl Ether → Methanesulfonic Acid

HRID 666482Notes

Reaction equation

HRID 666482 reaction equation
[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[CH3:42][CH2:43][O:44][CH2:45][CH3:46].[Cl:39][CH2:40][Cl:41].[n:6]1[cH:7][cH:8][n:9]2[n:10][c:11]([CH2:15][O:16][c:17]3[cH:18][cH:19][c:20]([C:23]4=[C:27]([c:28]5[cH:29][cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]5)[O:26][C:25]([CH3:36])([CH3:37])[C:24]4=[O:38])[cH:21][cH:22]3)[cH:12][cH:13][c:14]12>>[CH3:1][S:2](=[O:3])(=[O:4])[OH:5].[n:6]1[cH:7][cH:8][n:9]2[n:10][c:11]([CH2:15][O:16][c:17]3[cH:18][cH:19][c:20]([C:23]4=[C:27]([c:28]5[cH:29][cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]5)[O:26][C:25]([CH3:36])([CH3:37])[C:24]4=[O:38])[cH:21][cH:22]3)[cH:12][cH:13][c:14]12

Participants

6

Reactant 4

HCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 6395Methanesulfonic AcidHCID 497789784-(4-(imidazo[1,2-b]pyridazin-6-ylmethoxy)phenyl)-5-(4-methoxyphenyl)-2,2-dimethylfuran-3(2H)-one

Product 2

HCID 6395Methanesulfonic AcidHCID 497789784-(4-(imidazo[1,2-b]pyridazin-6-ylmethoxy)phenyl)-5-(4-methoxyphenyl)-2,2-dimethylfuran-3(2H)-one

Sources & evidence

ORD record
ord-e271af5a816c41fa90b6009dce713455
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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