Water → HCID 57736519, compound

HRID 702493Notes

Reaction equation

HRID 702493 reaction equation
[Br:1][c:2]1[n:3][cH:4][c:5]([CH:9]([c:10]2[c:11]([F:18])[c:12]([F:17])[cH:13][cH:14][c:15]2[F:16])[S:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:6]([CH3:8])[cH:7]1.[CH2:32]([Li:33])[CH2:34][CH2:35][CH3:36].[CH3:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31].[CH3:37][N:38]([CH:39]=[O:40])[CH3:41].[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[OH2:55]>>[c:2]1([CH:39]=[O:40])[n:3][cH:4][c:5]([CH:9]([c:10]2[c:11]([F:18])[c:12]([F:17])[cH:13][cH:14][c:15]2[F:16])[S:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)[c:6]([CH3:8])[cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 1140TolueneHCID 6228DimethylformamideHCID 8058HexaneHCID 8857Ethyl AcetateHCID 57736546HCID 57736546, compoundHCID 178418339Butyllithium

Product 1

HCID 57736519HCID 57736519, compound

Sources & evidence

ORD record
ord-4229973691d54a3fb04e88bc56822907
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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