Toluene → HCID 19075659, compound

HRID 297037Notes

Reaction equation

HRID 297037 reaction equation
[CH2:16]([c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[O:23][c:24]1[cH:25][cH:26][c:27]([OH:30])[cH:28][cH:29]1.[CH2:1]([CH3:2])[O:3][C:4]1=[N:8][CH:7]2[CH:6]([O:5]1)[c:15]1[c:10]([cH:11][cH:12][cH:13][cH:14]1)[CH2:9]2.[CH3:42][c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[CH3:49][CH2:50][O:51][CH2:52][CH3:53].[c:31]1([CH3:32])[cH:33][cH:34][c:35]([S:36]([OH:37])(=[O:38])=[O:39])[cH:40][cH:41]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[NH:8][CH:7]1[CH:6]([O:30][c:27]2[cH:26][cH:25][c:24]([O:23][CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[cH:29][cH:28]2)[c:15]2[c:10]([cH:11][cH:12][cH:13][cH:14]2)[CH2:9]1

Participants

6

Reactant 5

HCID 1140TolueneHCID 3283Diethyl EtherHCID 6101p-Toluenesulfonic acidHCID 7638MonobenzoneHCID 13595718HCID 13595718, compound

Product 1

HCID 19075659HCID 19075659, compound

Sources & evidence

ORD record
ord-449277819f114631af4ea4b5523c9b49
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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