Methanol → HCID 22132747, compound

HRID 2148458Notes

Reaction equation

HRID 2148458 reaction equation
[CH3:44][OH:45].[CH:46]([Cl:47])([Cl:48])[Cl:49].[Cl:1][c:2]1[c:3]([N+:33]([O-:34])=[O:35])[cH:4][c:5]([NH:8][C:9](=[O:10])[NH:11][c:12]2[cH:13][cH:14][c:15]([O:18][c:19]3[cH:20][cH:21][n:22][c:23]4[cH:24][c:25]([O:31][CH3:32])[c:26]([O:29][CH3:30])[cH:27][c:28]34)[cH:16][cH:17]2)[cH:6][cH:7]1.[Na+:41].[Na+:42].[OH2:43].[S:36]([O-:37])([O-:38])(=[O:39])=[S:40]>>[Cl:1][c:2]1[c:3]([NH2:33])[cH:4][c:5]([NH:8][C:9](=[O:10])[NH:11][c:12]2[cH:13][cH:14][c:15]([O:18][c:19]3[cH:20][cH:21][n:22][c:23]4[cH:24][c:25]([O:31][CH3:32])[c:26]([O:29][CH3:30])[cH:27][c:28]34)[cH:16][cH:17]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 1084Thiosulfate ionHCID 6212ChloroformHCID 22132678HCID 22132678, compound

Product 1

HCID 22132747HCID 22132747, compound

Sources & evidence

ORD record
ord-20f83e80095e4321ab2e78d6f98a1e05
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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