Benzene → HCID 67065996, compound

HRID 674061Notes

Reaction equation

HRID 674061 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]([OH:14])([c:15]2[c:16]([F:23])[cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[CH2:12][CH2:13]1.[OH2:24].[c:25]1([CH3:26])[cH:27][cH:28][c:29]([S:30]([OH:31])(=[O:32])=[O:33])[cH:34][cH:35]1.[cH:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]=[C:11]([c:15]2[c:16]([F:23])[cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[CH2:12][CH2:13]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 670660104-(2-Fluoro-4-methoxyphenyl)-1-(phenylmethyl)-4-piperidinol

Product 1

HCID 67065996HCID 67065996, compound

Sources & evidence

ORD record
ord-fa9079d8718a443a9c3bb8b576445d3c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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