Toluene → HCID 70550907, compound

HRID 289384Notes

Reaction equation

HRID 289384 reaction equation
[C:15](=[O:16])([OH:17])[c:18]1[c:19]([CH:20]=[O:21])[cH:22][cH:23][cH:24][cH:25]1.[CH3:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([C:9](=[O:10])[O:11][CH2:12][CH3:13])[CH3:14])[cH:6][cH:7]1.[c:26]1([CH3:27])[cH:28][cH:29][c:30]([S:31]([OH:32])(=[O:33])=[O:34])[cH:35][cH:36]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH:8]([C:9](=[O:10])[O:11][CH2:12][CH3:13])[CH3:14])[cH:6][cH:7]1)[CH:20]1[c:19]2[c:18]([cH:25][cH:24][cH:23][cH:22]2)[C:15](=[O:16])[O:21]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 8406Phthalaldehydic acidHCID 118009Ethyl 2-(4-aminophenyl)propanoate

Product 1

HCID 70550907HCID 70550907, compound

Sources & evidence

ORD record
ord-66632430c7014326ade75c5dbac707ab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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