Water → HCID 57736460, compound

HRID 2310600Notes

Reaction equation

HRID 2310600 reaction equation
[Br:1][c:2]1[n:3][cH:4][c:5]([CH:9]([S:10][c:11]2[n:12][cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]2)[c:21]2[c:22]([F:28])[cH:23][cH:24][c:25]([F:27])[cH:26]2)[c:6]([CH3:8])[cH:7]1.[CH2:35]([Li:36])[CH2:37][CH2:38][CH3:39].[CH3:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:40][N:41]([CH:42]=[O:43])[CH3:44].[CH3:45][c:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1.[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[OH2:58]>>[c:2]1([CH:42]=[O:43])[n:3][cH:4][c:5]([CH:9]([S:10][c:11]2[n:12][cH:13][c:14]([C:17]([F:18])([F:19])[F:20])[cH:15][cH:16]2)[c:21]2[c:22]([F:28])[cH:23][cH:24][c:25]([F:27])[cH:26]2)[c:6]([CH3:8])[cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 1140TolueneHCID 6228DimethylformamideHCID 8058HexaneHCID 8857Ethyl AcetateHCID 57736507HCID 57736507, compoundHCID 178418339Butyllithium

Product 1

HCID 57736460HCID 57736460, compound

Sources & evidence

ORD record
ord-e5d904fb38d54a69866d839ceb842e76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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