Benzene → HCID 20257375, compound

HRID 1143822Notes

Reaction equation

HRID 1143822 reaction equation
[CH2:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[N:14]1[C:15]([CH3:29])([CH3:30])[CH2:16][CH2:17][c:18]2[cH:19][c:20]([CH:24]([C:25](=[O:26])[OH:27])[CH3:28])[cH:21][cH:22][c:23]21.[Cl:42][c:43]1[cH:44][cH:45][c:46]([CH2:47][OH:48])[cH:49][cH:50]1.[OH2:51].[c:31]1([CH3:32])[cH:33][cH:34][c:35]([S:36]([OH:37])(=[O:38])=[O:39])[cH:40][cH:41]1.[cH:1]1[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[CH2:7]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[N:14]1[C:15]([CH3:29])([CH3:30])[CH2:16][CH2:17][c:18]2[cH:19][c:20]([CH:24]([C:25](=[O:26])[O:27][CH2:47][c:46]3[cH:45][cH:44][c:43]([Cl:42])[cH:50][cH:49]3)[CH3:28])[cH:21][cH:22][c:23]21

Participants

6

Reactant 5

HCID 241BenzeneHCID 962WaterHCID 6101p-Toluenesulfonic acidHCID 133974-Chlorobenzyl alcoholHCID 13206084HCID 13206084, compound

Product 1

HCID 20257375HCID 20257375, compound

Sources & evidence

ORD record
ord-45800c5dc920499590331c0fa420f22a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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